Organooxygen compounds
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Indole-6-methanol, 97%, Thermo Scientific™
CAS: 1075-26-9 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD02179595 InChI Key: WRMZOPANDOHWJU-UHFFFAOYSA-N Synonym: 6-hydroxymethylindole,1h-indol-6-yl methanol,indole-6-methanol,1h-indole-6-methanol,indol-6-ylmethan-1-ol,indol-6-yl-methanol,pubchem7966,6-hydroxymethyl indole,6-indolmethanol PubChem CID: 2773459 SMILES: OCC1=CC=C2C=CNC2=C1
| PubChem CID | 2773459 |
|---|---|
| CAS | 1075-26-9 |
| Molecular Weight (g/mol) | 147.18 |
| MDL Number | MFCD02179595 |
| SMILES | OCC1=CC=C2C=CNC2=C1 |
| Synonym | 6-hydroxymethylindole,1h-indol-6-yl methanol,indole-6-methanol,1h-indole-6-methanol,indol-6-ylmethan-1-ol,indol-6-yl-methanol,pubchem7966,6-hydroxymethyl indole,6-indolmethanol |
| InChI Key | WRMZOPANDOHWJU-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO |
4-Hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane 1-oxide, 98%
CAS: 5301-78-0 Molecular Formula: C5H9O5P Molecular Weight (g/mol): 180.096 MDL Number: MFCD01677612 InChI Key: YASRHLDAFCMIPB-UHFFFAOYSA-N PubChem CID: 199942 IUPAC Name: (1-oxo-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octan-4-yl)methanol SMILES: C1C2(COP(=O)(O1)OC2)CO
| PubChem CID | 199942 |
|---|---|
| CAS | 5301-78-0 |
| Molecular Weight (g/mol) | 180.096 |
| MDL Number | MFCD01677612 |
| SMILES | C1C2(COP(=O)(O1)OC2)CO |
| IUPAC Name | (1-oxo-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octan-4-yl)methanol |
| InChI Key | YASRHLDAFCMIPB-UHFFFAOYSA-N |
| Molecular Formula | C5H9O5P |
Chlorogenic acid, 99.45%, For HPLC analysis, MP Biomedicals™
CAS: 327-97-9 Molecular Formula: C16H18O9 Molecular Weight (g/mol): 354.31 MDL Number: MFCD00003862 InChI Key: CWVRJTMFETXNAD-JUHZACGLSA-N Synonym: chlorogenic acid,3-caffeoylquinic acid,chlorogenate,3-o-caffeoylquinic acid,3-3,4-dihydroxycinnamoyl quinic acid,heriguard,hlorogenic acid,caffeoyl quinic acid,3-caffeoylquinate,unii-318adp12ri PubChem CID: 1794427 ChEBI: CHEBI:16112 IUPAC Name: (1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid SMILES: O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\C2=CC=C(O)C(O)=C2)[C@@H]1O)C(O)=O
| PubChem CID | 1794427 |
|---|---|
| CAS | 327-97-9 |
| Molecular Weight (g/mol) | 354.31 |
| ChEBI | CHEBI:16112 |
| MDL Number | MFCD00003862 |
| SMILES | O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\C2=CC=C(O)C(O)=C2)[C@@H]1O)C(O)=O |
| Synonym | chlorogenic acid,3-caffeoylquinic acid,chlorogenate,3-o-caffeoylquinic acid,3-3,4-dihydroxycinnamoyl quinic acid,heriguard,hlorogenic acid,caffeoyl quinic acid,3-caffeoylquinate,unii-318adp12ri |
| IUPAC Name | (1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid |
| InChI Key | CWVRJTMFETXNAD-JUHZACGLSA-N |
| Molecular Formula | C16H18O9 |
Neopentyl alcohol, 99%
CAS: 75-84-3 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00004682 InChI Key: KPSSIOMAKSHJJG-UHFFFAOYSA-N Synonym: neopentyl alcohol,2,2-dimethyl-1-propanol,2,2-dimethylpropanol,tert-butylcarbinol,1-propanol, 2,2-dimethyl,tert-butyl carbinol,neopentanol,neopentylalcohol,neoamyl alcohol,2,2-dimethylpropyl alcohol PubChem CID: 6404 IUPAC Name: 2,2-dimethylpropan-1-ol SMILES: CC(C)(C)CO
| PubChem CID | 6404 |
|---|---|
| CAS | 75-84-3 |
| Molecular Weight (g/mol) | 88.15 |
| MDL Number | MFCD00004682 |
| SMILES | CC(C)(C)CO |
| Synonym | neopentyl alcohol,2,2-dimethyl-1-propanol,2,2-dimethylpropanol,tert-butylcarbinol,1-propanol, 2,2-dimethyl,tert-butyl carbinol,neopentanol,neopentylalcohol,neoamyl alcohol,2,2-dimethylpropyl alcohol |
| IUPAC Name | 2,2-dimethylpropan-1-ol |
| InChI Key | KPSSIOMAKSHJJG-UHFFFAOYSA-N |
| Molecular Formula | C5H12O |
3,4-Dihydro-2H-chromen-3-ylmethanol, 97%, Thermo Scientific™
CAS: 76727-28-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD04972641 InChI Key: UPDSWAQIQZFOLF-UHFFFAOYSA-N PubChem CID: 2795460 IUPAC Name: 3,4-dihydro-2H-chromen-3-ylmethanol SMILES: C1C(COC2=CC=CC=C21)CO
| PubChem CID | 2795460 |
|---|---|
| CAS | 76727-28-1 |
| Molecular Weight (g/mol) | 164.204 |
| MDL Number | MFCD04972641 |
| SMILES | C1C(COC2=CC=CC=C21)CO |
| IUPAC Name | 3,4-dihydro-2H-chromen-3-ylmethanol |
| InChI Key | UPDSWAQIQZFOLF-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
DL-6-Methoxy-alpha-methyl-2-naphthalenemethanol, 98%
CAS: 77301-42-9 Molecular Formula: C13H14O2 Molecular Weight (g/mol): 202.25 MDL Number: MFCD01632581 InChI Key: OUVJWFRUESFCCY-SECBINFHSA-N Synonym: 1-6-methoxy-2-naphthyl ethanol,1-6-methoxynaphthalen-2-yl ethanol,1-6'-methoxy-2-naphthyl ethanol,+/--1-6-methoxynaphthyl ethanol,2-1-hydroxyethyl-6-methoxynaphthalene,1-6-methoxynaphthalen-2-yl ethan-1-ol,6-methoxy-alpha-methyl-2-naphthalenemethanol,1rs-1-6-methoxy-2-naphthyl ethanol naproxen impurity k,1-6-methoxy-2-naphthyl ethan-1-ol,naproxen impurity k PubChem CID: 575523 IUPAC Name: 1-(6-methoxynaphthalen-2-yl)ethanol SMILES: COC1=CC=C2C=C(C=CC2=C1)[C@@H](C)O
| PubChem CID | 575523 |
|---|---|
| CAS | 77301-42-9 |
| Molecular Weight (g/mol) | 202.25 |
| MDL Number | MFCD01632581 |
| SMILES | COC1=CC=C2C=C(C=CC2=C1)[C@@H](C)O |
| Synonym | 1-6-methoxy-2-naphthyl ethanol,1-6-methoxynaphthalen-2-yl ethanol,1-6'-methoxy-2-naphthyl ethanol,+/--1-6-methoxynaphthyl ethanol,2-1-hydroxyethyl-6-methoxynaphthalene,1-6-methoxynaphthalen-2-yl ethan-1-ol,6-methoxy-alpha-methyl-2-naphthalenemethanol,1rs-1-6-methoxy-2-naphthyl ethanol naproxen impurity k,1-6-methoxy-2-naphthyl ethan-1-ol,naproxen impurity k |
| IUPAC Name | 1-(6-methoxynaphthalen-2-yl)ethanol |
| InChI Key | OUVJWFRUESFCCY-SECBINFHSA-N |
| Molecular Formula | C13H14O2 |
(S)-1-Phenyl-1,3-propanediol, 98%
CAS: 96854-34-1 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00221510 InChI Key: RRVFYOSEKOTFOG-VIFPVBQESA-N Synonym: 1s-1-phenylpropane-1,3-diol,s-1-phenyl-1,3-propanediol,s-1-phenylpropane-1,3-diol,1s-phenyl-1,3-propanediol,s-1-phenyl-propane-1,3-diol,s, ?-1-phenyl-1,3-propanediol,1,3-propanediol,1-phenyl-, 1s,1,3-propanediol, 1-phenyl-, 1s,s---1-phenyl-1,3-propanediol, puriss sum of enantiomers, gc PubChem CID: 6950537 IUPAC Name: (1S)-1-phenylpropane-1,3-diol SMILES: C1=CC=C(C=C1)C(CCO)O
| PubChem CID | 6950537 |
|---|---|
| CAS | 96854-34-1 |
| Molecular Weight (g/mol) | 152.19 |
| MDL Number | MFCD00221510 |
| SMILES | C1=CC=C(C=C1)C(CCO)O |
| Synonym | 1s-1-phenylpropane-1,3-diol,s-1-phenyl-1,3-propanediol,s-1-phenylpropane-1,3-diol,1s-phenyl-1,3-propanediol,s-1-phenyl-propane-1,3-diol,s, ?-1-phenyl-1,3-propanediol,1,3-propanediol,1-phenyl-, 1s,1,3-propanediol, 1-phenyl-, 1s,s---1-phenyl-1,3-propanediol, puriss sum of enantiomers, gc |
| IUPAC Name | (1S)-1-phenylpropane-1,3-diol |
| InChI Key | RRVFYOSEKOTFOG-VIFPVBQESA-N |
| Molecular Formula | C9H12O2 |
Propylene Glycol, FCC, 99.5%, Spectrum™ Chemical
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CAS: 57-55-6 Molecular Formula: C3H8O2 Molecular Weight (g/mol): 76.10 InChI Key: DNIAPMSPPWPWGF-UHFFFAOYNA-N IUPAC Name: propane-1,2-diol SMILES: CC(O)CO
| CAS | 57-55-6 |
|---|---|
| Molecular Weight (g/mol) | 76.10 |
| SMILES | CC(O)CO |
| IUPAC Name | propane-1,2-diol |
| InChI Key | DNIAPMSPPWPWGF-UHFFFAOYNA-N |
| Molecular Formula | C3H8O2 |
3,3-Dimethyl-1-butanol, 97%
CAS: 624-95-3 Molecular Formula: C6H14O Molecular Weight (g/mol): 102.18 MDL Number: MFCD00002928 InChI Key: DUXCSEISVMREAX-UHFFFAOYSA-N Synonym: 3,3-dimethyl-1-butanol,3,3-dimethylbutanol,1-butanol, 3,3-dimethyl,neohexanol,unii-543oyd666t,tert-hexyl alcohol,3,3-dimethyl-butan-1-ol,chembl25029,tert-hexanol,pubchem3096 PubChem CID: 12233 IUPAC Name: 3,3-dimethylbutan-1-ol SMILES: CC(C)(C)CCO
| PubChem CID | 12233 |
|---|---|
| CAS | 624-95-3 |
| Molecular Weight (g/mol) | 102.18 |
| MDL Number | MFCD00002928 |
| SMILES | CC(C)(C)CCO |
| Synonym | 3,3-dimethyl-1-butanol,3,3-dimethylbutanol,1-butanol, 3,3-dimethyl,neohexanol,unii-543oyd666t,tert-hexyl alcohol,3,3-dimethyl-butan-1-ol,chembl25029,tert-hexanol,pubchem3096 |
| IUPAC Name | 3,3-dimethylbutan-1-ol |
| InChI Key | DUXCSEISVMREAX-UHFFFAOYSA-N |
| Molecular Formula | C6H14O |
(6-Thien-2-ylpyrid-3-yl)methanol, 95%, Thermo Scientific™
CAS: 198078-57-8 Molecular Formula: C10H9NOS Molecular Weight (g/mol): 191.248 MDL Number: MFCD06410427 InChI Key: OLHQRPWNQRBQMA-UHFFFAOYSA-N Synonym: 6-thien-2-ylpyrid-3-yl methanol,6-thiophen-2-yl pyridin-3-yl methanol,3-pyridinemethanol,6-2-thienyl,2-thien-2-yl-5-hydroxymethylpyridine,6-2-thienyl-3-pyridyl methan-1-ol PubChem CID: 15411145 IUPAC Name: (6-thiophen-2-ylpyridin-3-yl)methanol SMILES: C1=CSC(=C1)C2=NC=C(C=C2)CO
| PubChem CID | 15411145 |
|---|---|
| CAS | 198078-57-8 |
| Molecular Weight (g/mol) | 191.248 |
| MDL Number | MFCD06410427 |
| SMILES | C1=CSC(=C1)C2=NC=C(C=C2)CO |
| Synonym | 6-thien-2-ylpyrid-3-yl methanol,6-thiophen-2-yl pyridin-3-yl methanol,3-pyridinemethanol,6-2-thienyl,2-thien-2-yl-5-hydroxymethylpyridine,6-2-thienyl-3-pyridyl methan-1-ol |
| IUPAC Name | (6-thiophen-2-ylpyridin-3-yl)methanol |
| InChI Key | OLHQRPWNQRBQMA-UHFFFAOYSA-N |
| Molecular Formula | C10H9NOS |
Ergosterol, 96%, may cont. up to ca 6% water
CAS: 57-87-4 Molecular Formula: C28H44O MDL Number: MFCD00003623 InChI Key: DNVPQKQSNYMLRS-APGDWVJJSA-N PubChem CID: 444679 ChEBI: CHEBI:16933
| PubChem CID | 444679 |
|---|---|
| CAS | 57-87-4 |
| ChEBI | CHEBI:16933 |
| MDL Number | MFCD00003623 |
| InChI Key | DNVPQKQSNYMLRS-APGDWVJJSA-N |
| Molecular Formula | C28H44O |
2-Cyclopropylethanol, 96%
CAS: 2566-44-1 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00040762 InChI Key: LUNMJRJMSXZSLC-UHFFFAOYSA-N Synonym: cyclopropaneethanol,2-cyclopropylethan-1-ol,2-cyclopropyl-ethanol,2-hydroxyethyl cyclopropane,cyclopropaneethanol∼ 2-hydroxyethyl cyclopropane,2-cyclopropyl ethanol,2-cyclopropane ethanol,acmc-1cgpb,cyclopropylmethyl carbinol,intermediates-zcf02687 PubChem CID: 137642 SMILES: OCCC1CC1
| PubChem CID | 137642 |
|---|---|
| CAS | 2566-44-1 |
| Molecular Weight (g/mol) | 86.13 |
| MDL Number | MFCD00040762 |
| SMILES | OCCC1CC1 |
| Synonym | cyclopropaneethanol,2-cyclopropylethan-1-ol,2-cyclopropyl-ethanol,2-hydroxyethyl cyclopropane,cyclopropaneethanol∼ 2-hydroxyethyl cyclopropane,2-cyclopropyl ethanol,2-cyclopropane ethanol,acmc-1cgpb,cyclopropylmethyl carbinol,intermediates-zcf02687 |
| InChI Key | LUNMJRJMSXZSLC-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
(S)-(+)-2,3-O-Isopropylideneglycerol, 98%
CAS: 22323-82-6 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.16 MDL Number: MFCD00063239 InChI Key: RNVYQYLELCKWAN-UHFFFAOYNA-N Synonym: s-+-2,2-dimethyl-1,3-dioxolane-4-methanol,s-glycerol acetonide,s-+-1,2-isopropylideneglycerol,4s-2,2-dimethyl-1,3-dioxolan-4-yl methanol,s-2,2-dimethyl-1,3-dioxolane-4-methanol,s-solketal,1,2-isopropylidene-sn-glycerol,s-+-2,3-o-isopropylideneglycerol,1,3-dioxolane-4-methanol, 2,2-dimethyl-, 4s,s-2,2-dimethyl-1,3-dioxolan-4-yl methanol PubChem CID: 736057 IUPAC Name: [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol SMILES: CC1(C)OCC(CO)O1
| PubChem CID | 736057 |
|---|---|
| CAS | 22323-82-6 |
| Molecular Weight (g/mol) | 132.16 |
| MDL Number | MFCD00063239 |
| SMILES | CC1(C)OCC(CO)O1 |
| Synonym | s-+-2,2-dimethyl-1,3-dioxolane-4-methanol,s-glycerol acetonide,s-+-1,2-isopropylideneglycerol,4s-2,2-dimethyl-1,3-dioxolan-4-yl methanol,s-2,2-dimethyl-1,3-dioxolane-4-methanol,s-solketal,1,2-isopropylidene-sn-glycerol,s-+-2,3-o-isopropylideneglycerol,1,3-dioxolane-4-methanol, 2,2-dimethyl-, 4s,s-2,2-dimethyl-1,3-dioxolan-4-yl methanol |
| IUPAC Name | [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol |
| InChI Key | RNVYQYLELCKWAN-UHFFFAOYNA-N |
| Molecular Formula | C6H12O3 |
(R)-4-(1-Hydroxyethyl)pyridine, 99+%, (99+% ee), Thermo Scientific™
CAS: 27854-88-2 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.15 MDL Number: MFCD00077865 InChI Key: HVOAMIOKNARIMR-ZCFIWIBFSA-N Synonym: r-1-pyridin-4-yl ethanol,r-+-1-4-pyridyl ethanol,1r-1-pyridin-4-yl ethan-1-ol,r-1-4-pyridyl ethanol,1r-1-pyridin-4-yl ethanol,r-4-1-hydroxyethyl pyridine,1r-1-pyridin-4-ylethanol,r-1-pyridin-4-yl-ethanol,1r-1-4-pyridyl ethanol PubChem CID: 11804747 IUPAC Name: (1R)-1-pyridin-4-ylethanol SMILES: CC(C1=CC=NC=C1)O
| PubChem CID | 11804747 |
|---|---|
| CAS | 27854-88-2 |
| Molecular Weight (g/mol) | 123.15 |
| MDL Number | MFCD00077865 |
| SMILES | CC(C1=CC=NC=C1)O |
| Synonym | r-1-pyridin-4-yl ethanol,r-+-1-4-pyridyl ethanol,1r-1-pyridin-4-yl ethan-1-ol,r-1-4-pyridyl ethanol,1r-1-pyridin-4-yl ethanol,r-4-1-hydroxyethyl pyridine,1r-1-pyridin-4-ylethanol,r-1-pyridin-4-yl-ethanol,1r-1-4-pyridyl ethanol |
| IUPAC Name | (1R)-1-pyridin-4-ylethanol |
| InChI Key | HVOAMIOKNARIMR-ZCFIWIBFSA-N |
| Molecular Formula | C7H9NO |
cis-3-Methylcyclohexanol, 95%, Thermo Scientific Chemicals
CAS: 24965-90-0 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.188 MDL Number: MFCD00067155 InChI Key: HTSABYAWKQAHBT-RQJHMYQMSA-N Synonym: cis-3-methylcyclohexanol,cyclohexanol, 3-methyl-, cis,1s,3r-3-methylcyclohexan-1-ol,3-methyl cyclohexanol, cis,3-methylcyclohexanol, z,cis 3-methylcyclohexanol,cis-3-methyl-cyclohexanol,1s,3r-3-methyl-cyclohexanol,1alpha-3alpha-methylcyclohexanol PubChem CID: 229503 IUPAC Name: (1S,3R)-3-methylcyclohexan-1-ol SMILES: CC1CCCC(C1)O
| PubChem CID | 229503 |
|---|---|
| CAS | 24965-90-0 |
| Molecular Weight (g/mol) | 114.188 |
| MDL Number | MFCD00067155 |
| SMILES | CC1CCCC(C1)O |
| Synonym | cis-3-methylcyclohexanol,cyclohexanol, 3-methyl-, cis,1s,3r-3-methylcyclohexan-1-ol,3-methyl cyclohexanol, cis,3-methylcyclohexanol, z,cis 3-methylcyclohexanol,cis-3-methyl-cyclohexanol,1s,3r-3-methyl-cyclohexanol,1alpha-3alpha-methylcyclohexanol |
| IUPAC Name | (1S,3R)-3-methylcyclohexan-1-ol |
| InChI Key | HTSABYAWKQAHBT-RQJHMYQMSA-N |
| Molecular Formula | C7H14O |