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Enediols

Organic compounds that contain alkenes with a hydroxyl functional group on each carbon of the double bond (C=C).

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1

2-Ethoxyethanol, 99%, Thermo Scientific Chemicals

CAS: 110-80-5 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.12 MDL Number: MFCD00002869 InChI Key: ZNQVEEAIQZEUHB-UHFFFAOYSA-N Synonym: cellosolve,oxitol,ethyl cellosolve,ethylene glycol monoethyl ether,ethanol, 2-ethoxy,ethyl glycol,emkanol,hydroxy ether,ethylene glycol ethyl ether,dowanol ee PubChem CID: 8076 ChEBI: CHEBI:46788 IUPAC Name: 2-ethoxyethan-1-ol SMILES: CCOCCO

PubChem CID 8076
CAS 110-80-5
Molecular Weight (g/mol) 90.12
ChEBI CHEBI:46788
MDL Number MFCD00002869
SMILES CCOCCO
Synonym cellosolve,oxitol,ethyl cellosolve,ethylene glycol monoethyl ether,ethanol, 2-ethoxy,ethyl glycol,emkanol,hydroxy ether,ethylene glycol ethyl ether,dowanol ee
IUPAC Name 2-ethoxyethan-1-ol
InChI Key ZNQVEEAIQZEUHB-UHFFFAOYSA-N
Molecular Formula C4H10O2
2

2-Ethoxyethyl acetate, 98+%, Thermo Scientific Chemicals

CAS: 111-15-9 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.16 MDL Number: MFCD00009251 InChI Key: SVONRAPFKPVNKG-UHFFFAOYSA-N Synonym: ethylene glycol monoethyl ether acetate,cellosolve acetate,oxitol acetate,ethoxyethyl acetate,oxytol acetate,ethylglycol acetate,ethyl cellosolve acetate,1-acetoxy-2-ethoxyethane,ethylglykolacetat,octan etoksyetylu PubChem CID: 8095 IUPAC Name: 2-ethoxyethyl acetate SMILES: CCOCCOC(C)=O

PubChem CID 8095
CAS 111-15-9
Molecular Weight (g/mol) 132.16
MDL Number MFCD00009251
SMILES CCOCCOC(C)=O
Synonym ethylene glycol monoethyl ether acetate,cellosolve acetate,oxitol acetate,ethoxyethyl acetate,oxytol acetate,ethylglycol acetate,ethyl cellosolve acetate,1-acetoxy-2-ethoxyethane,ethylglykolacetat,octan etoksyetylu
IUPAC Name 2-ethoxyethyl acetate
InChI Key SVONRAPFKPVNKG-UHFFFAOYSA-N
Molecular Formula C6H12O3
3

4-Methoxyindole, 99%, Thermo Scientific Chemicals

CAS: 4837-90-5 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00009737 InChI Key: LUNOXNMCFPFPMO-UHFFFAOYSA-N Synonym: 4-methoxyindole,1h-indole, 4-methoxy,4-methoxylindole,1h-indol-4-yl methyl ether,indole, 4-methoxy,4-methoxy-indole,zlchem 710,pubchem7433,acmc-1aoxe PubChem CID: 138363 IUPAC Name: 4-methoxy-1H-indole SMILES: COC1=CC=CC2=C1C=CN2

PubChem CID 138363
CAS 4837-90-5
Molecular Weight (g/mol) 147.177
MDL Number MFCD00009737
SMILES COC1=CC=CC2=C1C=CN2
Synonym 4-methoxyindole,1h-indole, 4-methoxy,4-methoxylindole,1h-indol-4-yl methyl ether,indole, 4-methoxy,4-methoxy-indole,zlchem 710,pubchem7433,acmc-1aoxe
IUPAC Name 4-methoxy-1H-indole
InChI Key LUNOXNMCFPFPMO-UHFFFAOYSA-N
Molecular Formula C9H9NO
4

Cyclocytidine hydrochloride, 98+%, Thermo Scientific Chemicals

CAS: 10212-25-6 Molecular Formula: C9H12ClN3O4 Molecular Weight (g/mol): 261.66 MDL Number: MFCD00012636 InChI Key: KZOWNALBTMILAP-JBMRGDGGSA-N Synonym: cyclocytidine hydrochloride 1g PubChem CID: 74764394 ChEBI: CHEBI:74843 IUPAC Name: (2R,3R,3aS,9aR)-2-(hydroxymethyl)-6-imino-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-3-ol;hydron;chloride SMILES: Cl.OC[C@H]1O[C@@H]2[C@@H](OC3=NC(=N)C=CN23)[C@@H]1O

PubChem CID 74764394
CAS 10212-25-6
Molecular Weight (g/mol) 261.66
ChEBI CHEBI:74843
MDL Number MFCD00012636
SMILES Cl.OC[C@H]1O[C@@H]2[C@@H](OC3=NC(=N)C=CN23)[C@@H]1O
Synonym cyclocytidine hydrochloride 1g
IUPAC Name (2R,3R,3aS,9aR)-2-(hydroxymethyl)-6-imino-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-3-ol;hydron;chloride
InChI Key KZOWNALBTMILAP-JBMRGDGGSA-N
Molecular Formula C9H12ClN3O4
5

Tripropyl orthoformate, 98%, Thermo Scientific™

CAS: 621-76-1 Molecular Formula: C10H22O3 Molecular Weight (g/mol): 190.29 MDL Number: MFCD00015214 InChI Key: RWNXXQFJBALKAX-UHFFFAOYSA-N Synonym: tripropyl orthoformate,tri-n-propyl orthoformate,orthoformic acid tripropyl ester,1-dipropoxymethoxy propane,unii-z8f0df6af9,propane, 1,1',1-methylidynetris oxy tris,z8f0df6af9,tripropoxymethane,tripropylorthoformate PubChem CID: 69311 IUPAC Name: 1-(dipropoxymethoxy)propane SMILES: CCCOC(OCCC)OCCC

PubChem CID 69311
CAS 621-76-1
Molecular Weight (g/mol) 190.29
MDL Number MFCD00015214
SMILES CCCOC(OCCC)OCCC
Synonym tripropyl orthoformate,tri-n-propyl orthoformate,orthoformic acid tripropyl ester,1-dipropoxymethoxy propane,unii-z8f0df6af9,propane, 1,1',1-methylidynetris oxy tris,z8f0df6af9,tripropoxymethane,tripropylorthoformate
IUPAC Name 1-(dipropoxymethoxy)propane
InChI Key RWNXXQFJBALKAX-UHFFFAOYSA-N
Molecular Formula C10H22O3
6

3-Methoxypropylamine, 99+%, Thermo Scientific Chemicals

CAS: 5332-73-0 Molecular Formula: C4H11NO Molecular Weight (g/mol): 89.14 MDL Number: MFCD00014831 InChI Key: FAXDZWQIWUSWJH-UHFFFAOYSA-N Synonym: 3-methoxypropylamine,1-propanamine, 3-methoxy,1-amino-3-methoxypropane,3-aminopropyl methyl ether,3-methyoxypropylamine,3-methoxy-n-propylamine,3-methoxy-1-propanamine,propylamine, 3-methoxy,3-mpa,propanolamine methyl ether PubChem CID: 1672 IUPAC Name: 3-methoxypropan-1-amine SMILES: COCCCN

PubChem CID 1672
CAS 5332-73-0
Molecular Weight (g/mol) 89.14
MDL Number MFCD00014831
SMILES COCCCN
Synonym 3-methoxypropylamine,1-propanamine, 3-methoxy,1-amino-3-methoxypropane,3-aminopropyl methyl ether,3-methyoxypropylamine,3-methoxy-n-propylamine,3-methoxy-1-propanamine,propylamine, 3-methoxy,3-mpa,propanolamine methyl ether
IUPAC Name 3-methoxypropan-1-amine
InChI Key FAXDZWQIWUSWJH-UHFFFAOYSA-N
Molecular Formula C4H11NO
7

5,6-Dimethoxyindole, 98%, Thermo Scientific Chemicals

CAS: 14430-23-0 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.20 MDL Number: MFCD00005675 InChI Key: QODBZRNBPUPLEZ-UHFFFAOYSA-N PubChem CID: 84431 IUPAC Name: 5,6-dimethoxy-1H-indole SMILES: COC1=C(OC)C=C2C=CNC2=C1

PubChem CID 84431
CAS 14430-23-0
Molecular Weight (g/mol) 177.20
MDL Number MFCD00005675
SMILES COC1=C(OC)C=C2C=CNC2=C1
IUPAC Name 5,6-dimethoxy-1H-indole
InChI Key QODBZRNBPUPLEZ-UHFFFAOYSA-N
Molecular Formula C10H11NO2
8

Fumaraldehyde bis(dimethylacetal), 90%, Thermo Scientific™

CAS: 6068-62-8 Molecular Formula: C8H16O4 Molecular Weight (g/mol): 176.21 MDL Number: MFCD00075507 InChI Key: ZFGVCDSFRAMNMT-AATRIKPKSA-N Synonym: fumaraldehyde bis dimethyl acetal,e-1,1,4,4-tetramethoxybut-2-ene,fumaraldehyde bis dimethylacetal,2-butenedial bis dimethyl acetal,1,1,4,4-tetramethoxy-trans-2-butene,trans-1,1,4,4-tetramethoxy-2-butene,1,1,4,4-tetramethoxy-but-2-ene PubChem CID: 5862719 IUPAC Name: (E)-1,1,4,4-tetramethoxybut-2-ene SMILES: COC(C=CC(OC)OC)OC

PubChem CID 5862719
CAS 6068-62-8
Molecular Weight (g/mol) 176.21
MDL Number MFCD00075507
SMILES COC(C=CC(OC)OC)OC
Synonym fumaraldehyde bis dimethyl acetal,e-1,1,4,4-tetramethoxybut-2-ene,fumaraldehyde bis dimethylacetal,2-butenedial bis dimethyl acetal,1,1,4,4-tetramethoxy-trans-2-butene,trans-1,1,4,4-tetramethoxy-2-butene,1,1,4,4-tetramethoxy-but-2-ene
IUPAC Name (E)-1,1,4,4-tetramethoxybut-2-ene
InChI Key ZFGVCDSFRAMNMT-AATRIKPKSA-N
Molecular Formula C8H16O4
9

3-bromopropionaldehyde dimethylacetal, 95%, Thermo Scientific Chemicals

CAS: 36255-44-4 Molecular Formula: C5H11BrO2 Molecular Weight (g/mol): 183.045 MDL Number: MFCD00013245 InChI Key: ODZZAIFAQLODKN-UHFFFAOYSA-N Synonym: 3-bromopropionaldehyde dimethyl acetal,1-bromo-3,3-dimethoxypropane,propane, 3-bromo-1,1-dimethoxy,3-bromo-1,1-dimethoxy-propane,acmc-209ilq,3,3-dimethoxypropyl bromide,3-bromopropanal dimethylacetal,ksc495q3l,3-bromo-1,1dimethoxy-propane,1,1-dimethoxy-3-bromopropane PubChem CID: 118932 IUPAC Name: 3-bromo-1,1-dimethoxypropane SMILES: COC(CCBr)OC

PubChem CID 118932
CAS 36255-44-4
Molecular Weight (g/mol) 183.045
MDL Number MFCD00013245
SMILES COC(CCBr)OC
Synonym 3-bromopropionaldehyde dimethyl acetal,1-bromo-3,3-dimethoxypropane,propane, 3-bromo-1,1-dimethoxy,3-bromo-1,1-dimethoxy-propane,acmc-209ilq,3,3-dimethoxypropyl bromide,3-bromopropanal dimethylacetal,ksc495q3l,3-bromo-1,1dimethoxy-propane,1,1-dimethoxy-3-bromopropane
IUPAC Name 3-bromo-1,1-dimethoxypropane
InChI Key ODZZAIFAQLODKN-UHFFFAOYSA-N
Molecular Formula C5H11BrO2
10

1-Methoxy-2-butanol, Thermo Scientific Chemicals

CAS: 53778-73-7 Molecular Formula: C5H12O2 Molecular Weight (g/mol): 104.15 InChI Key: CSZZMFWKAQEMPB-UHFFFAOYNA-N IUPAC Name: 1-methoxybutan-2-ol SMILES: CCC(O)COC

CAS 53778-73-7
Molecular Weight (g/mol) 104.15
SMILES CCC(O)COC
IUPAC Name 1-methoxybutan-2-ol
InChI Key CSZZMFWKAQEMPB-UHFFFAOYNA-N
Molecular Formula C5H12O2
11

Phenylacetaldehyde dimethyl acetal, 98%, Thermo Scientific™

CAS: 101-48-4 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00008487 InChI Key: WNJSKZBEWNVKGU-UHFFFAOYSA-N Synonym: 2,2-dimethoxyethyl benzene,phenylacetaldehyde dimethyl acetal,viridine,hyscylene p,1,1-dimethoxy-2-phenylethane,benzene, 2,2-dimethoxyethyl,phenacetaldehyde dimethyl acetal,padma,2,2-dimethoxy-1-phenylethane,phenylacetic aldehyde dimethyl acetal PubChem CID: 60995 IUPAC Name: 2,2-dimethoxyethylbenzene SMILES: COC(CC1=CC=CC=C1)OC

PubChem CID 60995
CAS 101-48-4
Molecular Weight (g/mol) 166.22
MDL Number MFCD00008487
SMILES COC(CC1=CC=CC=C1)OC
Synonym 2,2-dimethoxyethyl benzene,phenylacetaldehyde dimethyl acetal,viridine,hyscylene p,1,1-dimethoxy-2-phenylethane,benzene, 2,2-dimethoxyethyl,phenacetaldehyde dimethyl acetal,padma,2,2-dimethoxy-1-phenylethane,phenylacetic aldehyde dimethyl acetal
IUPAC Name 2,2-dimethoxyethylbenzene
InChI Key WNJSKZBEWNVKGU-UHFFFAOYSA-N
12

3-Chromanecarboxylic acid, 97%, Thermo Scientific™

CAS: 115822-57-6 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD03783554 InChI Key: UGAGZMGJJFSKQM-UHFFFAOYSA-N Synonym: chroman-3-carboxylic acid,3-chromanecarboxylic acid,chromane-3-carboxylic acid,3,4-dihydro-2h-1-benzopyran-3-carboxylic acid,2h-1-benzopyran-3-carboxylic acid, 3,4-dihydro,2h-1-benzopyran-3-carboxylicacid, 3,4-dihydro,3,4-dihydro-2h-benzopyran-3-carboxylic acid PubChem CID: 2795458 IUPAC Name: 3,4-dihydro-2H-chromene-3-carboxylic acid SMILES: C1C(COC2=CC=CC=C21)C(=O)O

PubChem CID 2795458
CAS 115822-57-6
Molecular Weight (g/mol) 178.187
MDL Number MFCD03783554
SMILES C1C(COC2=CC=CC=C21)C(=O)O
Synonym chroman-3-carboxylic acid,3-chromanecarboxylic acid,chromane-3-carboxylic acid,3,4-dihydro-2h-1-benzopyran-3-carboxylic acid,2h-1-benzopyran-3-carboxylic acid, 3,4-dihydro,2h-1-benzopyran-3-carboxylicacid, 3,4-dihydro,3,4-dihydro-2h-benzopyran-3-carboxylic acid
IUPAC Name 3,4-dihydro-2H-chromene-3-carboxylic acid
InChI Key UGAGZMGJJFSKQM-UHFFFAOYSA-N
Molecular Formula C10H10O3
13

Propargylaldehyde diethyl acetal, 98%, Thermo Scientific Chemicals

CAS: 10160-87-9 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.17 MDL Number: MFCD00009237 InChI Key: RGUXEWWHSQGVRZ-UHFFFAOYSA-N PubChem CID: 66285 IUPAC Name: 3,3-diethoxyprop-1-yne SMILES: CCOC(OCC)C#C

PubChem CID 66285
CAS 10160-87-9
Molecular Weight (g/mol) 128.17
MDL Number MFCD00009237
SMILES CCOC(OCC)C#C
IUPAC Name 3,3-diethoxyprop-1-yne
InChI Key RGUXEWWHSQGVRZ-UHFFFAOYSA-N
Molecular Formula C7H12O2
15

3-methoxythiophene-2-carbaldehyde, 97%, Thermo Scientific™

CAS: 35134-07-7 Molecular Formula: C6H6O2S Molecular Weight (g/mol): 142.17 MDL Number: MFCD01571098 InChI Key: KGJDTMQUUPIAEF-UHFFFAOYSA-N Synonym: 3-methoxy-2-thiophenecarboxaldehyde,3-methoxythiophene-2-carboxaldehyde,2-thiophenecarboxaldehyde, 3-methoxy,3-methoxy-2-thenaldehyde,2-formyl-3-methoxythiophene,3-methoxy-2-thiophenealdehyde,3-methoxy-2-thiophenecarbaldehyde,3-methoxy-thiophene-2-carbaldehyde,2-thiophenecarboxaldehyde,3-methoxy,3-methoxy-2-thiophenecarbaldehyde # PubChem CID: 588315 IUPAC Name: 3-methoxythiophene-2-carbaldehyde SMILES: COC1=C(SC=C1)C=O

PubChem CID 588315
CAS 35134-07-7
Molecular Weight (g/mol) 142.17
MDL Number MFCD01571098
SMILES COC1=C(SC=C1)C=O
Synonym 3-methoxy-2-thiophenecarboxaldehyde,3-methoxythiophene-2-carboxaldehyde,2-thiophenecarboxaldehyde, 3-methoxy,3-methoxy-2-thenaldehyde,2-formyl-3-methoxythiophene,3-methoxy-2-thiophenealdehyde,3-methoxy-2-thiophenecarbaldehyde,3-methoxy-thiophene-2-carbaldehyde,2-thiophenecarboxaldehyde,3-methoxy,3-methoxy-2-thiophenecarbaldehyde #
IUPAC Name 3-methoxythiophene-2-carbaldehyde
InChI Key KGJDTMQUUPIAEF-UHFFFAOYSA-N
Molecular Formula C6H6O2S