Organooxygen compounds
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myo-Inositol 99.0+%, TCI America™
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CAS: 87-89-8 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00077932 InChI Key: CDAISMWEOUEBRE-UHFFFAOYSA-N Synonym: scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol PubChem CID: 892 ChEBI: CHEBI:24848 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexol SMILES: C1(C(C(C(C(C1O)O)O)O)O)O
| PubChem CID | 892 |
|---|---|
| CAS | 87-89-8 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:24848 |
| MDL Number | MFCD00077932 |
| SMILES | C1(C(C(C(C(C1O)O)O)O)O)O |
| Synonym | scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol |
| IUPAC Name | cyclohexane-1,2,3,4,5,6-hexol |
| InChI Key | CDAISMWEOUEBRE-UHFFFAOYSA-N |
| Molecular Formula | C6H12O6 |
n-Octanal 98.0+%, TCI America™
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CAS: 124-13-0 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.22 MDL Number: MFCD00007029 InChI Key: NUJGJRNETVAIRJ-UHFFFAOYSA-N Synonym: caprylic aldehyde,caprylaldehyde,n-octanal,1-octanal,n-octyl aldehyde,n-octaldehyde,n-caprylaldehyde,octanaldehyde,aldehyde c-8,n-octylal PubChem CID: 454 ChEBI: CHEBI:17935 IUPAC Name: octanal SMILES: CCCCCCCC=O
| PubChem CID | 454 |
|---|---|
| CAS | 124-13-0 |
| Molecular Weight (g/mol) | 128.22 |
| ChEBI | CHEBI:17935 |
| MDL Number | MFCD00007029 |
| SMILES | CCCCCCCC=O |
| Synonym | caprylic aldehyde,caprylaldehyde,n-octanal,1-octanal,n-octyl aldehyde,n-octaldehyde,n-caprylaldehyde,octanaldehyde,aldehyde c-8,n-octylal |
| IUPAC Name | octanal |
| InChI Key | NUJGJRNETVAIRJ-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
Methoxycyclopentane (stabilized with BHT) 99.5+%, TCI America™
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CAS: 5614-37-9 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.16 MDL Number: MFCD08276401 InChI Key: SKTCDJAMAYNROS-UHFFFAOYSA-N Synonym: cyclopentyl methyl ether,cyclopentane, methoxy,cpme,cyclopentane,methoxy,unii-4067e5gbkb,cyclopentylmethylether,cylopentylmethylether,methoxycyclopentane,2-methoxycyclopentyl,cylopentyl-methylether PubChem CID: 138539 IUPAC Name: methoxycyclopentane SMILES: COC1CCCC1
| PubChem CID | 138539 |
|---|---|
| CAS | 5614-37-9 |
| Molecular Weight (g/mol) | 100.16 |
| MDL Number | MFCD08276401 |
| SMILES | COC1CCCC1 |
| Synonym | cyclopentyl methyl ether,cyclopentane, methoxy,cpme,cyclopentane,methoxy,unii-4067e5gbkb,cyclopentylmethylether,cylopentylmethylether,methoxycyclopentane,2-methoxycyclopentyl,cylopentyl-methylether |
| IUPAC Name | methoxycyclopentane |
| InChI Key | SKTCDJAMAYNROS-UHFFFAOYSA-N |
| Molecular Formula | C6H12O |
trans-2-Methylcyclohexanol 98.0+%, TCI America™
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CAS: 7443-52-9 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.188 MDL Number: MFCD00064168 InChI Key: NDVWOBYBJYUSMF-RNFRBKRXSA-N Synonym: trans-2-methylcyclohexanol,cyclohexanol, 2-methyl-, trans,2-methylcyclohexanol trans,cyclohexanol, 2-methyl-, 1s,2r,2-methylcyclohexanol #,trans-2-methyl-cyclohexanol,1r,2r-2-methylcyclohexanol,2alpha-methylcyclohexan-1beta-ol,1r,2r-2-methyl-cyclohexanol PubChem CID: 24004 IUPAC Name: (1R,2R)-2-methylcyclohexan-1-ol SMILES: CC1CCCCC1O
| PubChem CID | 24004 |
|---|---|
| CAS | 7443-52-9 |
| Molecular Weight (g/mol) | 114.188 |
| MDL Number | MFCD00064168 |
| SMILES | CC1CCCCC1O |
| Synonym | trans-2-methylcyclohexanol,cyclohexanol, 2-methyl-, trans,2-methylcyclohexanol trans,cyclohexanol, 2-methyl-, 1s,2r,2-methylcyclohexanol #,trans-2-methyl-cyclohexanol,1r,2r-2-methylcyclohexanol,2alpha-methylcyclohexan-1beta-ol,1r,2r-2-methyl-cyclohexanol |
| IUPAC Name | (1R,2R)-2-methylcyclohexan-1-ol |
| InChI Key | NDVWOBYBJYUSMF-RNFRBKRXSA-N |
| Molecular Formula | C7H14O |
Haloperidol 98.0+%, TCI America™
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CAS: 52-86-8 Molecular Formula: C21H23ClFNO2 Molecular Weight (g/mol): 375.87 MDL Number: MFCD00051423 InChI Key: LNEPOXFFQSENCJ-UHFFFAOYSA-N Synonym: haloperidol,haldol,aloperidin,serenace,aloperidol,brotopon,eukystol,einalon s,aloperidolo,galoperidol PubChem CID: 3559 ChEBI: CHEBI:5613 IUPAC Name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butan-1-one SMILES: OC1(CCN(CCCC(=O)C2=CC=C(F)C=C2)CC1)C1=CC=C(Cl)C=C1
| PubChem CID | 3559 |
|---|---|
| CAS | 52-86-8 |
| Molecular Weight (g/mol) | 375.87 |
| ChEBI | CHEBI:5613 |
| MDL Number | MFCD00051423 |
| SMILES | OC1(CCN(CCCC(=O)C2=CC=C(F)C=C2)CC1)C1=CC=C(Cl)C=C1 |
| Synonym | haloperidol,haldol,aloperidin,serenace,aloperidol,brotopon,eukystol,einalon s,aloperidolo,galoperidol |
| IUPAC Name | 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butan-1-one |
| InChI Key | LNEPOXFFQSENCJ-UHFFFAOYSA-N |
| Molecular Formula | C21H23ClFNO2 |
Dichloromethyl Methyl Ether 97.0+%, TCI America™
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CAS: 4885-02-3 Molecular Formula: C2H4Cl2O Molecular Weight (g/mol): 114.95 MDL Number: MFCD00000828 InChI Key: GRTGGSXWHGKRSB-UHFFFAOYSA-N Synonym: dichloromethyl methyl ether,1,1-dichlorodimethyl ether,dichloro methoxy methane,methane, dichloromethoxy,ether, dichloromethyl methyl,alpha,alpha-dichloromethyl methyl ether,methoxydichloromethane,1,1-dichloromethyl methyl ether,alpha,alpha-dichloromethyl ether,dichloromethylmethylether PubChem CID: 21004 IUPAC Name: dichloro(methoxy)methane SMILES: COC(Cl)Cl
| PubChem CID | 21004 |
|---|---|
| CAS | 4885-02-3 |
| Molecular Weight (g/mol) | 114.95 |
| MDL Number | MFCD00000828 |
| SMILES | COC(Cl)Cl |
| Synonym | dichloromethyl methyl ether,1,1-dichlorodimethyl ether,dichloro methoxy methane,methane, dichloromethoxy,ether, dichloromethyl methyl,alpha,alpha-dichloromethyl methyl ether,methoxydichloromethane,1,1-dichloromethyl methyl ether,alpha,alpha-dichloromethyl ether,dichloromethylmethylether |
| IUPAC Name | dichloro(methoxy)methane |
| InChI Key | GRTGGSXWHGKRSB-UHFFFAOYSA-N |
| Molecular Formula | C2H4Cl2O |
1,4-Diacetylbenzene 99.0+%, TCI America™
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CAS: 1009-61-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00008750 InChI Key: SKBBQSLSGRSQAJ-UHFFFAOYSA-N Synonym: 1,4-diacetylbenzene,1,1'-1,4-phenylene diethanone,p-diacetylbenzene,p-acetylacetophenone,benzene, p-diacetyl,ethanone, 1,1'-1,4-phenylene bis,1-4-acetylphenyl ethanone,1-4-acetylphenyl ethan-1-one,1,1-1,4-phenylene bis-ethanone,4-acetylacetophenone PubChem CID: 13888 IUPAC Name: 1-(4-acetylphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(C=C1)C(C)=O
| PubChem CID | 13888 |
|---|---|
| CAS | 1009-61-6 |
| Molecular Weight (g/mol) | 162.19 |
| MDL Number | MFCD00008750 |
| SMILES | CC(=O)C1=CC=C(C=C1)C(C)=O |
| Synonym | 1,4-diacetylbenzene,1,1'-1,4-phenylene diethanone,p-diacetylbenzene,p-acetylacetophenone,benzene, p-diacetyl,ethanone, 1,1'-1,4-phenylene bis,1-4-acetylphenyl ethanone,1-4-acetylphenyl ethan-1-one,1,1-1,4-phenylene bis-ethanone,4-acetylacetophenone |
| IUPAC Name | 1-(4-acetylphenyl)ethan-1-one |
| InChI Key | SKBBQSLSGRSQAJ-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
Ethyl 3-Methyl-3-phenylglycidate (mixture of isomers) 95.0+%, TCI America™
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CAS: 77-83-8 Molecular Formula: C12H14O3 Molecular Weight (g/mol): 206.241 MDL Number: MFCD00022338 InChI Key: LQKRYVGRPXFFAV-UHFFFAOYSA-N Synonym: ethyl methylphenylglycidate,ethyl 3-methyl-3-phenylglycidate,strawberry aldehyde,fraeseol,empg,c-16 aldehyde,aldehyde c-16,ethyl methylphenyl glycidate,ethyl-3-methyl-3-phenylglycidate,ethyl 2,3-epoxy-3-phenylbutyrate PubChem CID: 6501 IUPAC Name: ethyl 3-methyl-3-phenyloxirane-2-carboxylate SMILES: CCOC(=O)C1C(O1)(C)C2=CC=CC=C2
| PubChem CID | 6501 |
|---|---|
| CAS | 77-83-8 |
| Molecular Weight (g/mol) | 206.241 |
| MDL Number | MFCD00022338 |
| SMILES | CCOC(=O)C1C(O1)(C)C2=CC=CC=C2 |
| Synonym | ethyl methylphenylglycidate,ethyl 3-methyl-3-phenylglycidate,strawberry aldehyde,fraeseol,empg,c-16 aldehyde,aldehyde c-16,ethyl methylphenyl glycidate,ethyl-3-methyl-3-phenylglycidate,ethyl 2,3-epoxy-3-phenylbutyrate |
| IUPAC Name | ethyl 3-methyl-3-phenyloxirane-2-carboxylate |
| InChI Key | LQKRYVGRPXFFAV-UHFFFAOYSA-N |
| Molecular Formula | C12H14O3 |
Sodium Anthraquinone-2-sulfonate Monohydrate 98.0+%, TCI America™
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CAS: 153277-35-1 Molecular Formula: C14H7NaO5S Molecular Weight (g/mol): 310.25 MDL Number: MFCD00001229 InChI Key: GGCZERPQGJTIQP-UHFFFAOYSA-M Synonym: sodium 9,10-dioxo-9,10-dihydroanthracene-2-sulfonate hydrate,anthraquinone-2-sulfonic acid sodium salt monohydrate,sodium anthraquinone-2-sulfonate monohydrate,sodium 9,10-dioxoanthracene-2-sulfonate hydrate,9,10-anthraquinone-2-sulfonic acid sodium salt hydrate,anthraquinone-2-sulfonic acid, sodium salt, monohydrate,9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid sodium salt,acmc-209bkc,c14h8o5s.na.h2o,anthraquinone-2-sulfonic acid sodium salt hydrate PubChem CID: 23666331 IUPAC Name: sodium 9,10-dioxo-9,10-dihydroanthracene-2-sulfonate SMILES: [Na+].[O-]S(=O)(=O)C1=CC=C2C(=O)C3=CC=CC=C3C(=O)C2=C1
| PubChem CID | 23666331 |
|---|---|
| CAS | 153277-35-1 |
| Molecular Weight (g/mol) | 310.25 |
| MDL Number | MFCD00001229 |
| SMILES | [Na+].[O-]S(=O)(=O)C1=CC=C2C(=O)C3=CC=CC=C3C(=O)C2=C1 |
| Synonym | sodium 9,10-dioxo-9,10-dihydroanthracene-2-sulfonate hydrate,anthraquinone-2-sulfonic acid sodium salt monohydrate,sodium anthraquinone-2-sulfonate monohydrate,sodium 9,10-dioxoanthracene-2-sulfonate hydrate,9,10-anthraquinone-2-sulfonic acid sodium salt hydrate,anthraquinone-2-sulfonic acid, sodium salt, monohydrate,9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid sodium salt,acmc-209bkc,c14h8o5s.na.h2o,anthraquinone-2-sulfonic acid sodium salt hydrate |
| IUPAC Name | sodium 9,10-dioxo-9,10-dihydroanthracene-2-sulfonate |
| InChI Key | GGCZERPQGJTIQP-UHFFFAOYSA-M |
| Molecular Formula | C14H7NaO5S |
4-Acetylbiphenyl 98.0+%, TCI America™
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CAS: 92-91-1 Molecular Formula: C14H12O Molecular Weight (g/mol): 196.249 MDL Number: MFCD00008749 InChI Key: QCZZSANNLWPGEA-UHFFFAOYSA-N Synonym: 4-acetylbiphenyl,4'-phenylacetophenone,4-phenylacetophenone,4-biphenylyl methyl ketone,p-phenylacetophenone,p-acetylbiphenyl,1-1,1'-biphenyl-4-yl ethanone,acetophenone, 4'-phenyl,1-4-phenylphenyl ethanone,ketone, 4-biphenylyl methyl PubChem CID: 7113 IUPAC Name: 1-(4-phenylphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
| PubChem CID | 7113 |
|---|---|
| CAS | 92-91-1 |
| Molecular Weight (g/mol) | 196.249 |
| MDL Number | MFCD00008749 |
| SMILES | CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2 |
| Synonym | 4-acetylbiphenyl,4'-phenylacetophenone,4-phenylacetophenone,4-biphenylyl methyl ketone,p-phenylacetophenone,p-acetylbiphenyl,1-1,1'-biphenyl-4-yl ethanone,acetophenone, 4'-phenyl,1-4-phenylphenyl ethanone,ketone, 4-biphenylyl methyl |
| IUPAC Name | 1-(4-phenylphenyl)ethanone |
| InChI Key | QCZZSANNLWPGEA-UHFFFAOYSA-N |
| Molecular Formula | C14H12O |
(R)-(+)-1-Phenylethyl Alcohol 98.0+%, TCI America™
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CAS: 1517-69-7 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00064263 InChI Key: WAPNOHKVXSQRPX-UHFFFAOYNA-N Synonym: r-1-phenylethanol,r-+-1-phenylethanol,1r-1-phenylethanol,r-alpha-methylbenzyl alcohol,r-+-sec-phenethyl alcohol,1r-1-phenylethan-1-ol,r-+-1-phenylethyl alcohol,1-phenylethanol, r,benzenemethanol, alpha-methyl-, r PubChem CID: 637516 ChEBI: CHEBI:45616 IUPAC Name: 1-phenylethan-1-ol SMILES: CC(O)C1=CC=CC=C1
| PubChem CID | 637516 |
|---|---|
| CAS | 1517-69-7 |
| Molecular Weight (g/mol) | 122.17 |
| ChEBI | CHEBI:45616 |
| MDL Number | MFCD00064263 |
| SMILES | CC(O)C1=CC=CC=C1 |
| Synonym | r-1-phenylethanol,r-+-1-phenylethanol,1r-1-phenylethanol,r-alpha-methylbenzyl alcohol,r-+-sec-phenethyl alcohol,1r-1-phenylethan-1-ol,r-+-1-phenylethyl alcohol,1-phenylethanol, r,benzenemethanol, alpha-methyl-, r |
| IUPAC Name | 1-phenylethan-1-ol |
| InChI Key | WAPNOHKVXSQRPX-UHFFFAOYNA-N |
| Molecular Formula | C8H10O |
3-Hydroxy-4,5-dimethoxybenzaldehyde 98.0+%, TCI America™
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CAS: 29865-90-5 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00010442 InChI Key: NVLTWXMZECWWPC-UHFFFAOYSA-N Synonym: 5-Hydroxyveratraldehyde, 5-Hydroxy-3,4-dimethoxybenzaldehyde PubChem CID: 141513 IUPAC Name: 3-hydroxy-4,5-dimethoxybenzaldehyde SMILES: COC1=CC(C=O)=CC(O)=C1OC
| PubChem CID | 141513 |
|---|---|
| CAS | 29865-90-5 |
| Molecular Weight (g/mol) | 182.18 |
| MDL Number | MFCD00010442 |
| SMILES | COC1=CC(C=O)=CC(O)=C1OC |
| Synonym | 5-Hydroxyveratraldehyde, 5-Hydroxy-3,4-dimethoxybenzaldehyde |
| IUPAC Name | 3-hydroxy-4,5-dimethoxybenzaldehyde |
| InChI Key | NVLTWXMZECWWPC-UHFFFAOYSA-N |
| Molecular Formula | C9H10O4 |
2,2-Dimethyl-1,3-dioxolane-4-methanol 98.0+%, TCI America™
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CAS: 100-79-8 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.159 MDL Number: MFCD00063238 InChI Key: RNVYQYLELCKWAN-UHFFFAOYSA-N Synonym: solketal,2,2-dimethyl-1,3-dioxolane-4-methanol,2,2-dimethyl-1,3-dioxolan-4-yl methanol,glycerolacetone,dioxolan,isopropylidene glycerol,1,2-isopropylideneglycerol,1,2-o-isopropylideneglycerol,1,3-dioxolane-4-methanol, 2,2-dimethyl,glycerol dimethylketal PubChem CID: 7528 IUPAC Name: (2,2-dimethyl-1,3-dioxolan-4-yl)methanol SMILES: CC1(OCC(O1)CO)C
| PubChem CID | 7528 |
|---|---|
| CAS | 100-79-8 |
| Molecular Weight (g/mol) | 132.159 |
| MDL Number | MFCD00063238 |
| SMILES | CC1(OCC(O1)CO)C |
| Synonym | solketal,2,2-dimethyl-1,3-dioxolane-4-methanol,2,2-dimethyl-1,3-dioxolan-4-yl methanol,glycerolacetone,dioxolan,isopropylidene glycerol,1,2-isopropylideneglycerol,1,2-o-isopropylideneglycerol,1,3-dioxolane-4-methanol, 2,2-dimethyl,glycerol dimethylketal |
| IUPAC Name | (2,2-dimethyl-1,3-dioxolan-4-yl)methanol |
| InChI Key | RNVYQYLELCKWAN-UHFFFAOYSA-N |
| Molecular Formula | C6H12O3 |
3'-Methoxyacetophenone 97.0+%, TCI America™
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CAS: 586-37-8 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00008736 InChI Key: BAYUSCHCCGXLAY-UHFFFAOYSA-N Synonym: 3'-methoxyacetophenone,3-methoxyacetophenone,3-acetylanisole,m-methoxyacetophenone,1-3-methoxyphenyl ethanone,ethanone, 1-3-methoxyphenyl,m-acetanisole,acetophenone, m-methoxy,1-3-methoxyphenyl ethan-1-one,acetophenone, 3'-methoxy PubChem CID: 11460 IUPAC Name: 1-(3-methoxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC=C1)OC
| PubChem CID | 11460 |
|---|---|
| CAS | 586-37-8 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00008736 |
| SMILES | CC(=O)C1=CC(=CC=C1)OC |
| Synonym | 3'-methoxyacetophenone,3-methoxyacetophenone,3-acetylanisole,m-methoxyacetophenone,1-3-methoxyphenyl ethanone,ethanone, 1-3-methoxyphenyl,m-acetanisole,acetophenone, m-methoxy,1-3-methoxyphenyl ethan-1-one,acetophenone, 3'-methoxy |
| IUPAC Name | 1-(3-methoxyphenyl)ethanone |
| InChI Key | BAYUSCHCCGXLAY-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
1-Phenylethane-1,2-diol 98.0+%, TCI America™
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CAS: 93-56-1 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00003546 InChI Key: PWMWNFMRSKOCEY-UHFFFAOYSA-N Synonym: 1-phenyl-1,2-ethanediol,styrene glycol,phenylethylene glycol,phenylethanediol,phenyl glycol,1,2-ethanediol, 1-phenyl,phenyl-1,2-ethanediol,styrolyl alcohol,fenylglycol,1-phenylethylene glycol PubChem CID: 7149 IUPAC Name: 1-phenylethane-1,2-diol SMILES: C1=CC=C(C=C1)C(CO)O
| PubChem CID | 7149 |
|---|---|
| CAS | 93-56-1 |
| Molecular Weight (g/mol) | 138.166 |
| MDL Number | MFCD00003546 |
| SMILES | C1=CC=C(C=C1)C(CO)O |
| Synonym | 1-phenyl-1,2-ethanediol,styrene glycol,phenylethylene glycol,phenylethanediol,phenyl glycol,1,2-ethanediol, 1-phenyl,phenyl-1,2-ethanediol,styrolyl alcohol,fenylglycol,1-phenylethylene glycol |
| IUPAC Name | 1-phenylethane-1,2-diol |
| InChI Key | PWMWNFMRSKOCEY-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |