Organooxygen compounds
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1,3-Propanediol, 98%
CAS: 504-63-2 Molecular Formula: C3H8O2 Molecular Weight (g/mol): 76.10 MDL Number: MFCD00002949 InChI Key: YPFDHNVEDLHUCE-UHFFFAOYSA-N Synonym: 1,3-propanediol,trimethylene glycol,1,3-dihydroxypropane,2-deoxyglycerol,1,3-propylene glycol,1,3-propylenediol,1,3-propandiol,2-hydroxymethyl ethanol,omega-propanediol,beta-propylene glycol PubChem CID: 10442 ChEBI: CHEBI:16109 IUPAC Name: propane-1,3-diol SMILES: OCCCO
| PubChem CID | 10442 |
|---|---|
| CAS | 504-63-2 |
| Molecular Weight (g/mol) | 76.10 |
| ChEBI | CHEBI:16109 |
| MDL Number | MFCD00002949 |
| SMILES | OCCCO |
| Synonym | 1,3-propanediol,trimethylene glycol,1,3-dihydroxypropane,2-deoxyglycerol,1,3-propylene glycol,1,3-propylenediol,1,3-propandiol,2-hydroxymethyl ethanol,omega-propanediol,beta-propylene glycol |
| IUPAC Name | propane-1,3-diol |
| InChI Key | YPFDHNVEDLHUCE-UHFFFAOYSA-N |
| Molecular Formula | C3H8O2 |
2-Benzo[b]furan-3-ylethanol, ≥95%, Thermo Scientific™
CAS: 75611-06-2 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD08271904 InChI Key: QBEGKDXITSPUTE-UHFFFAOYSA-N Synonym: 2-benzofuran-3-yl ethanol,2-benzo b furan-3-ylethanol,2-1-benzofuran-3-yl ethanol,2-1-benzofuran-3-yl ethan-1-ol,2-benzofuran-3-yl ;ethanol,2-benzo b furan-3-yl ethanol,2-benzo b furan-3-ylethan-1-ol PubChem CID: 10953836 IUPAC Name: 2-(1-benzofuran-3-yl)ethanol SMILES: C1=CC=C2C(=C1)C(=CO2)CCO
| PubChem CID | 10953836 |
|---|---|
| CAS | 75611-06-2 |
| Molecular Weight (g/mol) | 162.188 |
| MDL Number | MFCD08271904 |
| SMILES | C1=CC=C2C(=C1)C(=CO2)CCO |
| Synonym | 2-benzofuran-3-yl ethanol,2-benzo b furan-3-ylethanol,2-1-benzofuran-3-yl ethanol,2-1-benzofuran-3-yl ethan-1-ol,2-benzofuran-3-yl ;ethanol,2-benzo b furan-3-yl ethanol,2-benzo b furan-3-ylethan-1-ol |
| IUPAC Name | 2-(1-benzofuran-3-yl)ethanol |
| InChI Key | QBEGKDXITSPUTE-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
(5-Methyl-2-phenyl-3-furyl)methanol, 95%, Thermo Scientific™
CAS: 183210-33-5 Molecular Formula: C12H12O2 Molecular Weight (g/mol): 188.226 MDL Number: MFCD08435905 InChI Key: VZFFMWAZPODJRX-UHFFFAOYSA-N Synonym: 5-methyl-2-phenyl-3-furyl methanol,5-methyl-2-phenylfuran-3-yl methanol,3-furanmethanol,5-methyl-2-phenyl,5-methyl-2-phenyl-3-furyl methan-1-ol PubChem CID: 15269738 IUPAC Name: (5-methyl-2-phenylfuran-3-yl)methanol SMILES: CC1=CC(=C(O1)C2=CC=CC=C2)CO
| PubChem CID | 15269738 |
|---|---|
| CAS | 183210-33-5 |
| Molecular Weight (g/mol) | 188.226 |
| MDL Number | MFCD08435905 |
| SMILES | CC1=CC(=C(O1)C2=CC=CC=C2)CO |
| Synonym | 5-methyl-2-phenyl-3-furyl methanol,5-methyl-2-phenylfuran-3-yl methanol,3-furanmethanol,5-methyl-2-phenyl,5-methyl-2-phenyl-3-furyl methan-1-ol |
| IUPAC Name | (5-methyl-2-phenylfuran-3-yl)methanol |
| InChI Key | VZFFMWAZPODJRX-UHFFFAOYSA-N |
| Molecular Formula | C12H12O2 |
MilliporeSigma™ Phorbol-12,13-dibutyrate, Calbiochem™,
CAS: 37558-16-0 Molecular Formula: C28H40O8 Molecular Weight (g/mol): 504.62 InChI Key: BQJRUJTZSGYBEZ-YVQNUNKESA-N Synonym: phorbol 12,13-dibutyrate,pdbu,phorbol dibutyrate,phorbol 12,13-dibutanoate,phorbol-12,13-dibutyrate,unii-67mx82cl58,chembl27768,1ar,1bs,4ar,7as,7bs,8r,9r,9as-4a,7b-dihydroxy-3-hydroxymethyl-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9ah-cyclopropa 3,4 benzo 1,2-e azulene-9,9a-diyl dibutanoate,butanoic acid, 1ar,1bs,4ar,7as,7bs,8r,9r,9as-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-4a,7b-dihydroxy-3-hydroxymethyl-1,1,6,8-tetramethyl-5-oxo-9ah-cyclopropa 3,4 benz 1,2-e azulene-9,9a-diyl ester,butanoic acid, 1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-4a,7b-dihydroxy-3-hydroxymethyl-1,1,6,8-tetramethyl-5-oxo-9ah-cyclopropa 3,4 benz 1,2-e azulene-9,9a-diyl ester, 1ar-1a-alpha,1b-beta,4a-beta,7a-alpha,7b-alpha,8-alpha,9-beta,9a-alpha PubChem CID: 37783 ChEBI: CHEBI:17598 SMILES: CCCC(=O)OC1C(C2(C(C=C(CC3(C2C=C(C3=O)C)O)CO)C4C1(C4(C)C)OC(=O)CCC)O)C
| PubChem CID | 37783 |
|---|---|
| CAS | 37558-16-0 |
| Molecular Weight (g/mol) | 504.62 |
| ChEBI | CHEBI:17598 |
| SMILES | CCCC(=O)OC1C(C2(C(C=C(CC3(C2C=C(C3=O)C)O)CO)C4C1(C4(C)C)OC(=O)CCC)O)C |
| Synonym | phorbol 12,13-dibutyrate,pdbu,phorbol dibutyrate,phorbol 12,13-dibutanoate,phorbol-12,13-dibutyrate,unii-67mx82cl58,chembl27768,1ar,1bs,4ar,7as,7bs,8r,9r,9as-4a,7b-dihydroxy-3-hydroxymethyl-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9ah-cyclopropa 3,4 benzo 1,2-e azulene-9,9a-diyl dibutanoate,butanoic acid, 1ar,1bs,4ar,7as,7bs,8r,9r,9as-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-4a,7b-dihydroxy-3-hydroxymethyl-1,1,6,8-tetramethyl-5-oxo-9ah-cyclopropa 3,4 benz 1,2-e azulene-9,9a-diyl ester,butanoic acid, 1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-4a,7b-dihydroxy-3-hydroxymethyl-1,1,6,8-tetramethyl-5-oxo-9ah-cyclopropa 3,4 benz 1,2-e azulene-9,9a-diyl ester, 1ar-1a-alpha,1b-beta,4a-beta,7a-alpha,7b-alpha,8-alpha,9-beta,9a-alpha |
| InChI Key | BQJRUJTZSGYBEZ-YVQNUNKESA-N |
| Molecular Formula | C28H40O8 |
1-Phenylcyclohexanol, 97%
CAS: 1589-60-2 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.259 MDL Number: MFCD00021393 InChI Key: DTTDXHDYTWQDCS-UHFFFAOYSA-N Synonym: 1-phenylcyclohexanol,cyclohexanol, 1-phenyl,1-phenyl-1-cyclohexanol,phenylcyclohexanol,cyclohexanol, phenyl,1-phenylcyclohexanol-1,1-phenyl-cyclohexanol,maybridge1_002485,1-phenyl-cyclohexan-1-ol,acmc-209dj8 PubChem CID: 15319 IUPAC Name: 1-phenylcyclohexan-1-ol SMILES: C1CCC(CC1)(C2=CC=CC=C2)O
| PubChem CID | 15319 |
|---|---|
| CAS | 1589-60-2 |
| Molecular Weight (g/mol) | 176.259 |
| MDL Number | MFCD00021393 |
| SMILES | C1CCC(CC1)(C2=CC=CC=C2)O |
| Synonym | 1-phenylcyclohexanol,cyclohexanol, 1-phenyl,1-phenyl-1-cyclohexanol,phenylcyclohexanol,cyclohexanol, phenyl,1-phenylcyclohexanol-1,1-phenyl-cyclohexanol,maybridge1_002485,1-phenyl-cyclohexan-1-ol,acmc-209dj8 |
| IUPAC Name | 1-phenylcyclohexan-1-ol |
| InChI Key | DTTDXHDYTWQDCS-UHFFFAOYSA-N |
| Molecular Formula | C12H16O |
1,1,1-Trifluoroacetone cyanohydrin, 95%
CAS: 335-08-0 Molecular Formula: C4H4F3NO Molecular Weight (g/mol): 139.077 MDL Number: MFCD00040885 InChI Key: XDCMNDCKYSQKAX-UHFFFAOYSA-N Synonym: 1,1,1-trifluoroacetone cyanohydrin,2-cyano-1,1,1-trifluoro-2-propanol,2-hydroxy-2-trifluoromethyl propionitrile,propanenitrile, 3,3,3-trifluoro-2-hydroxy-2-methyl,2-trifluoromethyl lactonitrile,trifluoroacetone cyanohydrin,lactonitrile, 2-trifluoromethyl,3-trifluoro-a-hydroxyisobutyronitrile,lactonitrile,3,3-trifluoro-2-methyl,2-cyano-1,1,1-trifluoropropan-2-ol PubChem CID: 274400 IUPAC Name: 3,3,3-trifluoro-2-hydroxy-2-methylpropanenitrile SMILES: CC(C#N)(C(F)(F)F)O
| PubChem CID | 274400 |
|---|---|
| CAS | 335-08-0 |
| Molecular Weight (g/mol) | 139.077 |
| MDL Number | MFCD00040885 |
| SMILES | CC(C#N)(C(F)(F)F)O |
| Synonym | 1,1,1-trifluoroacetone cyanohydrin,2-cyano-1,1,1-trifluoro-2-propanol,2-hydroxy-2-trifluoromethyl propionitrile,propanenitrile, 3,3,3-trifluoro-2-hydroxy-2-methyl,2-trifluoromethyl lactonitrile,trifluoroacetone cyanohydrin,lactonitrile, 2-trifluoromethyl,3-trifluoro-a-hydroxyisobutyronitrile,lactonitrile,3,3-trifluoro-2-methyl,2-cyano-1,1,1-trifluoropropan-2-ol |
| IUPAC Name | 3,3,3-trifluoro-2-hydroxy-2-methylpropanenitrile |
| InChI Key | XDCMNDCKYSQKAX-UHFFFAOYSA-N |
| Molecular Formula | C4H4F3NO |
cis-4-(Boc-amino)cyclohexanol, 97%
CAS: 167081-25-6 Molecular Formula: C11H21NO3 Molecular Weight (g/mol): 215.29 MDL Number: MFCD03844613,MFCD03844614,MFCD06658349 InChI Key: DQARDWKWPIRJEH-UHFFFAOYSA-N Synonym: trans-4-boc-aminocyclohexanol,tert-butyl 4-hydroxycyclohexyl carbamate,boc-trans-4-aminocyclohexanol,4-boc-amino cyclohexanol,tert-butyl trans-4-hydroxycyclohexyl carbamate,tert-butyl n-4-hydroxycyclohexyl carbamate,tert-butyl cis-4-hydroxycyclohexylcarbamate,trans-n-boc-4-amino-cyclohexanol,4-n-boc-amino-cyclohexanol,tert-butyl cis-4-hydroxycyclohexyl carbamate PubChem CID: 1514287 IUPAC Name: tert-butyl N-(4-hydroxycyclohexyl)carbamate SMILES: CC(C)(C)OC(=O)NC1CCC(O)CC1
| PubChem CID | 1514287 |
|---|---|
| CAS | 167081-25-6 |
| Molecular Weight (g/mol) | 215.29 |
| MDL Number | MFCD03844613,MFCD03844614,MFCD06658349 |
| SMILES | CC(C)(C)OC(=O)NC1CCC(O)CC1 |
| Synonym | trans-4-boc-aminocyclohexanol,tert-butyl 4-hydroxycyclohexyl carbamate,boc-trans-4-aminocyclohexanol,4-boc-amino cyclohexanol,tert-butyl trans-4-hydroxycyclohexyl carbamate,tert-butyl n-4-hydroxycyclohexyl carbamate,tert-butyl cis-4-hydroxycyclohexylcarbamate,trans-n-boc-4-amino-cyclohexanol,4-n-boc-amino-cyclohexanol,tert-butyl cis-4-hydroxycyclohexyl carbamate |
| IUPAC Name | tert-butyl N-(4-hydroxycyclohexyl)carbamate |
| InChI Key | DQARDWKWPIRJEH-UHFFFAOYSA-N |
| Molecular Formula | C11H21NO3 |
cis-1,2-Cyclohexanediol, 99%
CAS: 1792-81-0 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00064944 InChI Key: PFURGBBHAOXLIO-OLQVQODUSA-N Synonym: cis-1,2-cyclohexanediol,cis-cyclohexane-1,2-diol,grandidentol,cis-1,2-dihydroxycyclohexane,1r,2s-cyclohexane-1,2-diol,1,2-cyclohexanediol, cis,1,2-cyclohexanediol, cis-8ci 9ci,1,2-cyclohexanediol, 1r,2s-rel,cis-1,2-cyclohexandiol,1alpha,2alpha-cyclohexanediol PubChem CID: 92903 ChEBI: CHEBI:32329 IUPAC Name: (1R,2S)-cyclohexane-1,2-diol SMILES: C1CCC(C(C1)O)O
| PubChem CID | 92903 |
|---|---|
| CAS | 1792-81-0 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:32329 |
| MDL Number | MFCD00064944 |
| SMILES | C1CCC(C(C1)O)O |
| Synonym | cis-1,2-cyclohexanediol,cis-cyclohexane-1,2-diol,grandidentol,cis-1,2-dihydroxycyclohexane,1r,2s-cyclohexane-1,2-diol,1,2-cyclohexanediol, cis,1,2-cyclohexanediol, cis-8ci 9ci,1,2-cyclohexanediol, 1r,2s-rel,cis-1,2-cyclohexandiol,1alpha,2alpha-cyclohexanediol |
| IUPAC Name | (1R,2S)-cyclohexane-1,2-diol |
| InChI Key | PFURGBBHAOXLIO-OLQVQODUSA-N |
| Molecular Formula | C6H12O2 |
Spectrum Chemical Manufacturing Corporation 1,3-Butanediol, 99%, Spectrum™ Chemical
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CAS: 107-88-0
| CAS | 107-88-0 |
|---|
Cyclopentanemethanol, 98%
CAS: 3637-61-4 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.161 MDL Number: MFCD00001384 InChI Key: ISQVBYGGNVVVHB-UHFFFAOYSA-N Synonym: cyclopentanemethanol,cyclopentyl-methanol,cyclopentylcarbinol,cyclopentylmethyl alcohol,cyclopentanmethanol,cylcopentanemethanol,cyclopentan-methanol,cyclopentyl methanol,cyclopentyl carbinol,cyclo-pentanemethanol PubChem CID: 77195 IUPAC Name: cyclopentylmethanol SMILES: C1CCC(C1)CO
| PubChem CID | 77195 |
|---|---|
| CAS | 3637-61-4 |
| Molecular Weight (g/mol) | 100.161 |
| MDL Number | MFCD00001384 |
| SMILES | C1CCC(C1)CO |
| Synonym | cyclopentanemethanol,cyclopentyl-methanol,cyclopentylcarbinol,cyclopentylmethyl alcohol,cyclopentanmethanol,cylcopentanemethanol,cyclopentan-methanol,cyclopentyl methanol,cyclopentyl carbinol,cyclo-pentanemethanol |
| IUPAC Name | cyclopentylmethanol |
| InChI Key | ISQVBYGGNVVVHB-UHFFFAOYSA-N |
| Molecular Formula | C6H12O |
Pyrogallol, 98+%
CAS: 87-66-1 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.11 MDL Number: MFCD00002192 InChI Key: WQGWDDDVZFFDIG-UHFFFAOYSA-N Synonym: pyrogallol,1,2,3-trihydroxybenzene,pyrogallic acid,1,2,3-benzenetriol,fouramine brown ap,fourrine pg,fourrine 85,pyro,c.i. oxidation base 32,piral PubChem CID: 1057 ChEBI: CHEBI:16164 IUPAC Name: benzene-1,2,3-triol SMILES: OC1=CC=CC(O)=C1O
| PubChem CID | 1057 |
|---|---|
| CAS | 87-66-1 |
| Molecular Weight (g/mol) | 126.11 |
| ChEBI | CHEBI:16164 |
| MDL Number | MFCD00002192 |
| SMILES | OC1=CC=CC(O)=C1O |
| Synonym | pyrogallol,1,2,3-trihydroxybenzene,pyrogallic acid,1,2,3-benzenetriol,fouramine brown ap,fourrine pg,fourrine 85,pyro,c.i. oxidation base 32,piral |
| IUPAC Name | benzene-1,2,3-triol |
| InChI Key | WQGWDDDVZFFDIG-UHFFFAOYSA-N |
| Molecular Formula | C6H6O3 |
(+/-)-1-Phenylethanol, 97%
CAS: 98-85-1 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.167 MDL Number: MFCD00004508 InChI Key: WAPNOHKVXSQRPX-UHFFFAOYSA-N Synonym: methylphenyl carbinol,1-phenylethan-1-ol,alpha-methylbenzyl alcohol,styralyl alcohol,1-phenethyl alcohol,styrallyl alcohol,methylphenylcarbinol,1-phenylethyl alcohol,phenylmethylcarbinol,1-hydroxyethyl benzene PubChem CID: 7409 ChEBI: CHEBI:669 IUPAC Name: 1-phenylethanol SMILES: CC(C1=CC=CC=C1)O
| PubChem CID | 7409 |
|---|---|
| CAS | 98-85-1 |
| Molecular Weight (g/mol) | 122.167 |
| ChEBI | CHEBI:669 |
| MDL Number | MFCD00004508 |
| SMILES | CC(C1=CC=CC=C1)O |
| Synonym | methylphenyl carbinol,1-phenylethan-1-ol,alpha-methylbenzyl alcohol,styralyl alcohol,1-phenethyl alcohol,styrallyl alcohol,methylphenylcarbinol,1-phenylethyl alcohol,phenylmethylcarbinol,1-hydroxyethyl benzene |
| IUPAC Name | 1-phenylethanol |
| InChI Key | WAPNOHKVXSQRPX-UHFFFAOYSA-N |
| Molecular Formula | C8H10O |
| CAS | 2325-10-2 |
|---|---|
| MDL Number | MFCD00064255 |
(R)-(-)-4-Methylmandelic acid, ChiPros∣r, 98%, ee 97+%
CAS: 31284-89-6 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00798433,MFCD00961860 InChI Key: SFGURAWGCAPHON-UHFFFAOYNA-N Synonym: 2-hydroxy-2-4-methylphenyl acetic acid,4-methylmandelic acid,p-methyl mandelic acid,2-hydroxy-2-p-tolyl acetic acid,hydroxy 4-methylphenyl acetic acid,hydroxy-p-tolyl-acetic acid,p-methylmandelic acid,4-methylmaldelic acid,p-methyl-mandelic acid,acmc-1afsj PubChem CID: 12458823 IUPAC Name: (2R)-2-hydroxy-2-(4-methylphenyl)acetic acid SMILES: CC1=CC=C(C=C1)C(O)C(O)=O
| PubChem CID | 12458823 |
|---|---|
| CAS | 31284-89-6 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00798433,MFCD00961860 |
| SMILES | CC1=CC=C(C=C1)C(O)C(O)=O |
| Synonym | 2-hydroxy-2-4-methylphenyl acetic acid,4-methylmandelic acid,p-methyl mandelic acid,2-hydroxy-2-p-tolyl acetic acid,hydroxy 4-methylphenyl acetic acid,hydroxy-p-tolyl-acetic acid,p-methylmandelic acid,4-methylmaldelic acid,p-methyl-mandelic acid,acmc-1afsj |
| IUPAC Name | (2R)-2-hydroxy-2-(4-methylphenyl)acetic acid |
| InChI Key | SFGURAWGCAPHON-UHFFFAOYNA-N |
| Molecular Formula | C9H10O3 |
3-Pentyn-1-ol, 98%
CAS: 10229-10-4 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.118 MDL Number: MFCD00002956 InChI Key: IDYNOORNKYEHHO-UHFFFAOYSA-N Synonym: 3-pentyn-1-ol,3-pentynol,acmc-1bxad PubChem CID: 66295 IUPAC Name: pent-3-yn-1-ol SMILES: CC#CCCO
| PubChem CID | 66295 |
|---|---|
| CAS | 10229-10-4 |
| Molecular Weight (g/mol) | 84.118 |
| MDL Number | MFCD00002956 |
| SMILES | CC#CCCO |
| Synonym | 3-pentyn-1-ol,3-pentynol,acmc-1bxad |
| IUPAC Name | pent-3-yn-1-ol |
| InChI Key | IDYNOORNKYEHHO-UHFFFAOYSA-N |
| Molecular Formula | C5H8O |