Organooxygen compounds
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2-Naphthalenemethanol, 98%
CAS: 1592-38-7 Molecular Formula: C11H10O Molecular Weight (g/mol): 158.2 MDL Number: MFCD00004124 InChI Key: MFGWMAAZYZSWMY-UHFFFAOYSA-N Synonym: 2-naphthalenemethanol,2-naphthylmethanol,2-hydroxymethylnaphthalene,2-naphthalene methanol,2-naphthyl methanol,naphthalen-2-yl-methanol,naphthalen-2-yl methanol,2-naphthylmethan-1-ol,2-naphthylcarbinol,2na PubChem CID: 74128 ChEBI: CHEBI:27615 IUPAC Name: naphthalen-2-ylmethanol SMILES: C1=CC=C2C=C(C=CC2=C1)CO
| PubChem CID | 74128 |
|---|---|
| CAS | 1592-38-7 |
| Molecular Weight (g/mol) | 158.2 |
| ChEBI | CHEBI:27615 |
| MDL Number | MFCD00004124 |
| SMILES | C1=CC=C2C=C(C=CC2=C1)CO |
| Synonym | 2-naphthalenemethanol,2-naphthylmethanol,2-hydroxymethylnaphthalene,2-naphthalene methanol,2-naphthyl methanol,naphthalen-2-yl-methanol,naphthalen-2-yl methanol,2-naphthylmethan-1-ol,2-naphthylcarbinol,2na |
| IUPAC Name | naphthalen-2-ylmethanol |
| InChI Key | MFGWMAAZYZSWMY-UHFFFAOYSA-N |
| Molecular Formula | C11H10O |
3,4-Dichlorophenethyl alcohol, 97%
CAS: 35364-79-5 Molecular Formula: C8H8Cl2O Molecular Weight (g/mol): 191.051 MDL Number: MFCD00800673 InChI Key: GITOMJDYNUMCOV-UHFFFAOYSA-N Synonym: 2-3,4-dichlorophenyl ethanol,3,4-dichlorophenethyl alcohol,3,4-dichlorophenethylalcohol,2-3,4-dichlorophenyl ethan-1-ol,benzeneethanol, 3,4-dichloro,2-3,4-dichlorophenyl-ethanol,3,4-dichlorobenzeneethanol,benzeneethanol,3,4-dichloro,acmc-1adlk,2-3,4-dichloro-phenyl-ethanol PubChem CID: 244558 IUPAC Name: 2-(3,4-dichlorophenyl)ethanol SMILES: C1=CC(=C(C=C1CCO)Cl)Cl
| PubChem CID | 244558 |
|---|---|
| CAS | 35364-79-5 |
| Molecular Weight (g/mol) | 191.051 |
| MDL Number | MFCD00800673 |
| SMILES | C1=CC(=C(C=C1CCO)Cl)Cl |
| Synonym | 2-3,4-dichlorophenyl ethanol,3,4-dichlorophenethyl alcohol,3,4-dichlorophenethylalcohol,2-3,4-dichlorophenyl ethan-1-ol,benzeneethanol, 3,4-dichloro,2-3,4-dichlorophenyl-ethanol,3,4-dichlorobenzeneethanol,benzeneethanol,3,4-dichloro,acmc-1adlk,2-3,4-dichloro-phenyl-ethanol |
| IUPAC Name | 2-(3,4-dichlorophenyl)ethanol |
| InChI Key | GITOMJDYNUMCOV-UHFFFAOYSA-N |
| Molecular Formula | C8H8Cl2O |
Dihydromyrcenol, 99.1%, MP Biomedicals™
CAS: 18479-58-8 Molecular Formula: C10H20O Molecular Weight (g/mol): 156.269 MDL Number: MFCD00004474 InChI Key: XSNQECSCDATQEL-UHFFFAOYSA-N Synonym: dihydromyrcenol,2,6-dimethyl-7-octen-2-ol,7-octen-2-ol, 2,6-dimethyl,1,1,5-trimethyl-6-heptenol,1-2,6-dimethyloct-7-en-2-ol,dsstox_cid_9317,myrcenol, 6,10-dihydro,dsstox_rid_78761 PubChem CID: 29096 ChEBI: CHEBI:87528 IUPAC Name: 2,6-dimethyloct-7-en-2-ol SMILES: CC(CCCC(C)(C)O)C=C
| PubChem CID | 29096 |
|---|---|
| CAS | 18479-58-8 |
| Molecular Weight (g/mol) | 156.269 |
| ChEBI | CHEBI:87528 |
| MDL Number | MFCD00004474 |
| SMILES | CC(CCCC(C)(C)O)C=C |
| Synonym | dihydromyrcenol,2,6-dimethyl-7-octen-2-ol,7-octen-2-ol, 2,6-dimethyl,1,1,5-trimethyl-6-heptenol,1-2,6-dimethyloct-7-en-2-ol,dsstox_cid_9317,myrcenol, 6,10-dihydro,dsstox_rid_78761 |
| IUPAC Name | 2,6-dimethyloct-7-en-2-ol |
| InChI Key | XSNQECSCDATQEL-UHFFFAOYSA-N |
| Molecular Formula | C10H20O |
cis-1,2-Cyclopentanediol, 98%
CAS: 5057-98-7 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.13 MDL Number: MFCD00134192 InChI Key: VCVOSERVUCJNPR-SYDPRGILSA-N Synonym: cis-1,2-cyclopentanediol,cis-cyclopentane-1,2-diol,cis-1,2-dihydroxycyclopentane,1r,2s-cyclopentane-1,2-diol,1s,2r cyclopentane-1,2-diol,cis-1,2-cyclopentandiol,1,2-cis-cyclopentanediol,cis-1,2-cyclopen-tanediol,cis-cyclopenten-1,2-diol,1alpha,2alpha-cyclopentanediol PubChem CID: 2733293 IUPAC Name: (1R,2S)-cyclopentane-1,2-diol SMILES: C1CC(C(C1)O)O
| PubChem CID | 2733293 |
|---|---|
| CAS | 5057-98-7 |
| Molecular Weight (g/mol) | 102.13 |
| MDL Number | MFCD00134192 |
| SMILES | C1CC(C(C1)O)O |
| Synonym | cis-1,2-cyclopentanediol,cis-cyclopentane-1,2-diol,cis-1,2-dihydroxycyclopentane,1r,2s-cyclopentane-1,2-diol,1s,2r cyclopentane-1,2-diol,cis-1,2-cyclopentandiol,1,2-cis-cyclopentanediol,cis-1,2-cyclopen-tanediol,cis-cyclopenten-1,2-diol,1alpha,2alpha-cyclopentanediol |
| IUPAC Name | (1R,2S)-cyclopentane-1,2-diol |
| InChI Key | VCVOSERVUCJNPR-SYDPRGILSA-N |
| Molecular Formula | C5H10O2 |
1-Methoxy-2-methyl-2-propanol, 98+%
CAS: 3587-64-2 Molecular Formula: C5H12O2 Molecular Weight (g/mol): 104.15 MDL Number: MFCD03701584 InChI Key: MXUXZWFVAPTPAG-UHFFFAOYSA-N Synonym: 1-methoxy-2-methyl-2-propanol,2-propanol, 1-methoxy-2-methyl,acmc-20aott,2-methoxymethyl-2-propanol,1,1-dimethyl-2-methoxyethanol,2-propanol,1-methoxy-2-methyl,1-methoxy-2-methyl-2-propanol # PubChem CID: 77137 IUPAC Name: 1-methoxy-2-methylpropan-2-ol SMILES: COCC(C)(C)O
| PubChem CID | 77137 |
|---|---|
| CAS | 3587-64-2 |
| Molecular Weight (g/mol) | 104.15 |
| MDL Number | MFCD03701584 |
| SMILES | COCC(C)(C)O |
| Synonym | 1-methoxy-2-methyl-2-propanol,2-propanol, 1-methoxy-2-methyl,acmc-20aott,2-methoxymethyl-2-propanol,1,1-dimethyl-2-methoxyethanol,2-propanol,1-methoxy-2-methyl,1-methoxy-2-methyl-2-propanol # |
| IUPAC Name | 1-methoxy-2-methylpropan-2-ol |
| InChI Key | MXUXZWFVAPTPAG-UHFFFAOYSA-N |
| Molecular Formula | C5H12O2 |
1-Naphthalenemethanol, 98+%
CAS: 4780-79-4 Molecular Formula: C11H10O Molecular Weight (g/mol): 158.20 MDL Number: MFCD00004044 InChI Key: PBLNHHSDYFYZNC-UHFFFAOYSA-N Synonym: 1-naphthalenemethanol,1-naphthylmethanol,1-hydroxymethylnaphthalene,naphthalene-1-methanol,1-naphthalene methanol,1-menaphthyl alcohol,1-naphthylmethyl alcohol,naphthalen-1-yl-methanol,naphthalen-1-yl methanol,1-naphthylenemethanol PubChem CID: 20908 ChEBI: CHEBI:38137 IUPAC Name: naphthalen-1-ylmethanol SMILES: OCC1=C2C=CC=CC2=CC=C1
| PubChem CID | 20908 |
|---|---|
| CAS | 4780-79-4 |
| Molecular Weight (g/mol) | 158.20 |
| ChEBI | CHEBI:38137 |
| MDL Number | MFCD00004044 |
| SMILES | OCC1=C2C=CC=CC2=CC=C1 |
| Synonym | 1-naphthalenemethanol,1-naphthylmethanol,1-hydroxymethylnaphthalene,naphthalene-1-methanol,1-naphthalene methanol,1-menaphthyl alcohol,1-naphthylmethyl alcohol,naphthalen-1-yl-methanol,naphthalen-1-yl methanol,1-naphthylenemethanol |
| IUPAC Name | naphthalen-1-ylmethanol |
| InChI Key | PBLNHHSDYFYZNC-UHFFFAOYSA-N |
| Molecular Formula | C11H10O |
3-Methyl-5-hexen-3-ol, 98%
CAS: 1569-44-4 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.19 MDL Number: MFCD00021826 InChI Key: GBARKLJMQRUBKV-UHFFFAOYNA-N Synonym: 3-methyl-5-hexen-3-ol,methylaethylallylcarbinol,methylethylallylcarbinol,5-hexen-3-ol, 3-methyl,methylaethylallylcarbinol german,5-hexen-3-ol, 3-methyl-, 3r,acmc-20m3dr,acmc-1bx1u,3-methyl-5-hexene-3-ol PubChem CID: 15288 IUPAC Name: 3-methylhex-5-en-3-ol SMILES: CCC(C)(O)CC=C
| PubChem CID | 15288 |
|---|---|
| CAS | 1569-44-4 |
| Molecular Weight (g/mol) | 114.19 |
| MDL Number | MFCD00021826 |
| SMILES | CCC(C)(O)CC=C |
| Synonym | 3-methyl-5-hexen-3-ol,methylaethylallylcarbinol,methylethylallylcarbinol,5-hexen-3-ol, 3-methyl,methylaethylallylcarbinol german,5-hexen-3-ol, 3-methyl-, 3r,acmc-20m3dr,acmc-1bx1u,3-methyl-5-hexene-3-ol |
| IUPAC Name | 3-methylhex-5-en-3-ol |
| InChI Key | GBARKLJMQRUBKV-UHFFFAOYNA-N |
| Molecular Formula | C7H14O |
Entecavir monohydrate, 99%, Thermo Scientific Chemicals
CAS: 209216-23-9 Molecular Formula: C12H15N5O3·H20 Molecular Weight (g/mol): 295.29 InChI Key: YXPVEXCTPGULBZ-WQYNNSOESA-N Synonym: entecavir hydrate,entecavir monohydrate,baraclude tn,entecavir usan,entecavir hydrate jan,baraclude,9-1s,3r,4s-4-hydroxy-3-hydroxymethyl-2-methylenecyclopentyl guanine monohydrate,entecavir inn,2-amino-9-1s,3r,4s-4-hydroxy-3-hydroxymethyl-2-methylidenecyclopentyl-1,9-dihydro-6h-purin-6-one-water 1/1 PubChem CID: 16052026 ChEBI: CHEBI:59902 IUPAC Name: 2-amino-9-[(1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl]-3H-purin-6-one;hydrate SMILES: C=C1C(CC(C1CO)O)N2C=NC3=C2NC(=NC3=O)N.O
| PubChem CID | 16052026 |
|---|---|
| CAS | 209216-23-9 |
| Molecular Weight (g/mol) | 295.29 |
| ChEBI | CHEBI:59902 |
| SMILES | C=C1C(CC(C1CO)O)N2C=NC3=C2NC(=NC3=O)N.O |
| Synonym | entecavir hydrate,entecavir monohydrate,baraclude tn,entecavir usan,entecavir hydrate jan,baraclude,9-1s,3r,4s-4-hydroxy-3-hydroxymethyl-2-methylenecyclopentyl guanine monohydrate,entecavir inn,2-amino-9-1s,3r,4s-4-hydroxy-3-hydroxymethyl-2-methylidenecyclopentyl-1,9-dihydro-6h-purin-6-one-water 1/1 |
| IUPAC Name | 2-amino-9-[(1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl]-3H-purin-6-one;hydrate |
| InChI Key | YXPVEXCTPGULBZ-WQYNNSOESA-N |
| Molecular Formula | C12H15N5O3·H20 |
Inositol, FCC, 97%, Spectrum™ Chemical
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CAS: 87-89-8 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.16 InChI Key: CDAISMWEOUEBRE-UHFFFAOYSA-N IUPAC Name: cyclohexane-1,2,3,4,5,6-hexol SMILES: OC1C(O)C(O)C(O)C(O)C1O
| CAS | 87-89-8 |
|---|---|
| Molecular Weight (g/mol) | 180.16 |
| SMILES | OC1C(O)C(O)C(O)C(O)C1O |
| IUPAC Name | cyclohexane-1,2,3,4,5,6-hexol |
| InChI Key | CDAISMWEOUEBRE-UHFFFAOYSA-N |
| Molecular Formula | C6H12O6 |
2-(1-Adamantyl)propan-2-ol, 97%, Thermo Scientific™
CAS: 775-64-4 Molecular Formula: C13H22O Molecular Weight (g/mol): 194.32 MDL Number: MFCD00167855 InChI Key: WBKAUEBLTWRERU-UHFFFAOYSA-N Synonym: 2-adamantan-1-yl-propan-2-ol,2-1-adamantyl propan-2-ol,2-adamantan-1-yl propan-2-ol,2-1-adamantyl-2-propanol,2-adamantanylpropan-2-ol,pubchem14445,maybridge1_005546,2-1-adamantly-2-propanol,2-1-adamantyl-propan-2-ol PubChem CID: 300814 SMILES: CC(C)(O)C12CC3CC(CC(C3)C1)C2
| PubChem CID | 300814 |
|---|---|
| CAS | 775-64-4 |
| Molecular Weight (g/mol) | 194.32 |
| MDL Number | MFCD00167855 |
| SMILES | CC(C)(O)C12CC3CC(CC(C3)C1)C2 |
| Synonym | 2-adamantan-1-yl-propan-2-ol,2-1-adamantyl propan-2-ol,2-adamantan-1-yl propan-2-ol,2-1-adamantyl-2-propanol,2-adamantanylpropan-2-ol,pubchem14445,maybridge1_005546,2-1-adamantly-2-propanol,2-1-adamantyl-propan-2-ol |
| InChI Key | WBKAUEBLTWRERU-UHFFFAOYSA-N |
| Molecular Formula | C13H22O |
2-Butyn-1-ol, 98%
CAS: 764-01-2 Molecular Formula: C4H6O Molecular Weight (g/mol): 70.09 MDL Number: MFCD00002914 InChI Key: NEEDEQSZOUAJMU-UHFFFAOYSA-N Synonym: 2-butyn-1-ol,2-butynol,2-butyne-1-ol,hydroxymethylmethylacetylene,2-butynyl alcohol,1-hydroxybut-2-yne,2-butyn-l-ol,2-butyn1-ol,2-butin-1-ol,but-2-in-1-ol PubChem CID: 12991 IUPAC Name: but-2-yn-1-ol SMILES: CC#CCO
| PubChem CID | 12991 |
|---|---|
| CAS | 764-01-2 |
| Molecular Weight (g/mol) | 70.09 |
| MDL Number | MFCD00002914 |
| SMILES | CC#CCO |
| Synonym | 2-butyn-1-ol,2-butynol,2-butyne-1-ol,hydroxymethylmethylacetylene,2-butynyl alcohol,1-hydroxybut-2-yne,2-butyn-l-ol,2-butyn1-ol,2-butin-1-ol,but-2-in-1-ol |
| IUPAC Name | but-2-yn-1-ol |
| InChI Key | NEEDEQSZOUAJMU-UHFFFAOYSA-N |
| Molecular Formula | C4H6O |
1-Octadecanol, 97%
CAS: 112-92-5 Molecular Formula: C18H38O Molecular Weight (g/mol): 270.501 MDL Number: MFCD00002823 InChI Key: GLDOVTGHNKAZLK-UHFFFAOYSA-N Synonym: stearyl alcohol,1-octadecanol,octadecanol,octadecyl alcohol,n-octadecanol,1-hydroxyoctadecane,n-1-octadecanol,stearol,n-octadecyl alcohol,stearic alcohol PubChem CID: 8221 ChEBI: CHEBI:32154 IUPAC Name: octadecan-1-ol SMILES: CCCCCCCCCCCCCCCCCCO
| PubChem CID | 8221 |
|---|---|
| CAS | 112-92-5 |
| Molecular Weight (g/mol) | 270.501 |
| ChEBI | CHEBI:32154 |
| MDL Number | MFCD00002823 |
| SMILES | CCCCCCCCCCCCCCCCCCO |
| Synonym | stearyl alcohol,1-octadecanol,octadecanol,octadecyl alcohol,n-octadecanol,1-hydroxyoctadecane,n-1-octadecanol,stearol,n-octadecyl alcohol,stearic alcohol |
| IUPAC Name | octadecan-1-ol |
| InChI Key | GLDOVTGHNKAZLK-UHFFFAOYSA-N |
| Molecular Formula | C18H38O |
2-Adamantanol, 98%
CAS: 700-57-2 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.237 MDL Number: MFCD00074744 InChI Key: FOWDOWQYRZXQDP-UHFFFAOYSA-N Synonym: 2-adamantanol,2-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-2-ol,tricyclo 3.3.1.1∼3,7∼ decan-2-ol,1r,3r,5r,7r-adamantan-2-ol,1-adamantanol;,2alpha-adamantanol,pubchem8753 PubChem CID: 64149 IUPAC Name: adamantan-2-ol SMILES: C1C2CC3CC1CC(C2)C3O
| PubChem CID | 64149 |
|---|---|
| CAS | 700-57-2 |
| Molecular Weight (g/mol) | 152.237 |
| MDL Number | MFCD00074744 |
| SMILES | C1C2CC3CC1CC(C2)C3O |
| Synonym | 2-adamantanol,2-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-2-ol,tricyclo 3.3.1.1∼3,7∼ decan-2-ol,1r,3r,5r,7r-adamantan-2-ol,1-adamantanol;,2alpha-adamantanol,pubchem8753 |
| IUPAC Name | adamantan-2-ol |
| InChI Key | FOWDOWQYRZXQDP-UHFFFAOYSA-N |
| Molecular Formula | C10H16O |
4-Bromo-1-butanol, tech., cont. varying amounts of THF
CAS: 33036-62-3 Molecular Formula: C4H9BrO Molecular Weight (g/mol): 153.019 MDL Number: MFCD00015387 InChI Key: SIJLYRDVTMMSIP-UHFFFAOYSA-N Synonym: 4-bromo-1-butanol,1-butanol, 4-bromo,4-bromobutanol,4-bromo-butan-1-ol,1-bromo-4-hydroxybutane,tetramethylene bromohydrin,4-bromo-n-butanol,1-bromobutan-4-ol,4-bromo butan-1-ol,acmc-1axcv PubChem CID: 118388 IUPAC Name: 4-bromobutan-1-ol SMILES: C(CCBr)CO
| PubChem CID | 118388 |
|---|---|
| CAS | 33036-62-3 |
| Molecular Weight (g/mol) | 153.019 |
| MDL Number | MFCD00015387 |
| SMILES | C(CCBr)CO |
| Synonym | 4-bromo-1-butanol,1-butanol, 4-bromo,4-bromobutanol,4-bromo-butan-1-ol,1-bromo-4-hydroxybutane,tetramethylene bromohydrin,4-bromo-n-butanol,1-bromobutan-4-ol,4-bromo butan-1-ol,acmc-1axcv |
| IUPAC Name | 4-bromobutan-1-ol |
| InChI Key | SIJLYRDVTMMSIP-UHFFFAOYSA-N |
| Molecular Formula | C4H9BrO |