Organooxygen compounds
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1,5-Pentanediol, 98%
CAS: 111-29-5 Molecular Formula: C5H12O2 Molecular Weight (g/mol): 104.15 MDL Number: MFCD00002978 InChI Key: ALQSHHUCVQOPAS-UHFFFAOYSA-N Synonym: 1,5-pentanediol,1,5-dihydroxypentane,pentylene glycol,pentamethylene glycol,1,5-pentylene glycol,1,5 pentanediol,1,5-pentamethylene glycol,alpha,omega-pentanediol,unii-07uxz0scst,1,5-pentandiol PubChem CID: 8105 IUPAC Name: pentane-1,5-diol SMILES: OCCCCCO
| PubChem CID | 8105 |
|---|---|
| CAS | 111-29-5 |
| Molecular Weight (g/mol) | 104.15 |
| MDL Number | MFCD00002978 |
| SMILES | OCCCCCO |
| Synonym | 1,5-pentanediol,1,5-dihydroxypentane,pentylene glycol,pentamethylene glycol,1,5-pentylene glycol,1,5 pentanediol,1,5-pentamethylene glycol,alpha,omega-pentanediol,unii-07uxz0scst,1,5-pentandiol |
| IUPAC Name | pentane-1,5-diol |
| InChI Key | ALQSHHUCVQOPAS-UHFFFAOYSA-N |
| Molecular Formula | C5H12O2 |
2-Hydroxyisobutyric acid, 99% (dry wt.), water <2%
CAS: 594-61-6 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00004459 InChI Key: BWLBGMIXKSTLSX-UHFFFAOYSA-N Synonym: 2-hydroxyisobutyric acid,2-methyllactic acid,acetonic acid,2-hydroxy-2-methylpropionic acid,alpha-hydroxyisobutyric acid,hydroxydimethylacetic acid,acetonate,propanoic acid, 2-hydroxy-2-methyl,alpha-hydroxyisobutanoic acid,2-hydroxyisobutyricacid PubChem CID: 11671 ChEBI: CHEBI:50129 IUPAC Name: 2-hydroxy-2-methylpropanoic acid SMILES: CC(C)(O)C(O)=O
| PubChem CID | 11671 |
|---|---|
| CAS | 594-61-6 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:50129 |
| MDL Number | MFCD00004459 |
| SMILES | CC(C)(O)C(O)=O |
| Synonym | 2-hydroxyisobutyric acid,2-methyllactic acid,acetonic acid,2-hydroxy-2-methylpropionic acid,alpha-hydroxyisobutyric acid,hydroxydimethylacetic acid,acetonate,propanoic acid, 2-hydroxy-2-methyl,alpha-hydroxyisobutanoic acid,2-hydroxyisobutyricacid |
| IUPAC Name | 2-hydroxy-2-methylpropanoic acid |
| InChI Key | BWLBGMIXKSTLSX-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |
2-(Bromomethyl)-2-(hydroxymethyl)-1,3-propanediol, 99%, Thermo Scientific Chemicals
CAS: 19184-65-7 Molecular Formula: C5H11BrO3 Molecular Weight (g/mol): 199.05 MDL Number: MFCD00135306 InChI Key: MMHHBAUIJVTLFZ-UHFFFAOYSA-N Synonym: 2-bromomethyl-2-hydroxymethyl propane-1,3-diol,2-bromomethyl-2-hydroxymethyl-1,3-propanediol,1,3-propanediol, 2-bromomethyl-2-hydroxymethyl,tris hydroxymethyl bromomethyl methane,monobromoneopentyltriol,2-bromoethylidynetrimethanol,pentaerythritol monobromohydrin,1, 2-bromomethyl-2-hydroxymethyl,2,2-bis hydroxymethyl-3-bromopropan-1-ol,2,2-bis hydroxymethyl-3-hydroxypropyl bromide PubChem CID: 87954 IUPAC Name: 2-(bromomethyl)-2-(hydroxymethyl)propane-1,3-diol SMILES: C(C(CO)(CO)CBr)O
| PubChem CID | 87954 |
|---|---|
| CAS | 19184-65-7 |
| Molecular Weight (g/mol) | 199.05 |
| MDL Number | MFCD00135306 |
| SMILES | C(C(CO)(CO)CBr)O |
| Synonym | 2-bromomethyl-2-hydroxymethyl propane-1,3-diol,2-bromomethyl-2-hydroxymethyl-1,3-propanediol,1,3-propanediol, 2-bromomethyl-2-hydroxymethyl,tris hydroxymethyl bromomethyl methane,monobromoneopentyltriol,2-bromoethylidynetrimethanol,pentaerythritol monobromohydrin,1, 2-bromomethyl-2-hydroxymethyl,2,2-bis hydroxymethyl-3-bromopropan-1-ol,2,2-bis hydroxymethyl-3-hydroxypropyl bromide |
| IUPAC Name | 2-(bromomethyl)-2-(hydroxymethyl)propane-1,3-diol |
| InChI Key | MMHHBAUIJVTLFZ-UHFFFAOYSA-N |
| Molecular Formula | C5H11BrO3 |
Hexylene Glycol, Reagent, 98%, Spectrum™ Chemical
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CAS: 107-41-5 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.18 InChI Key: SVTBMSDMJJWYQN-UHFFFAOYNA-N IUPAC Name: 2-methylpentane-2,4-diol SMILES: CC(O)CC(C)(C)O
| CAS | 107-41-5 |
|---|---|
| Molecular Weight (g/mol) | 118.18 |
| SMILES | CC(O)CC(C)(C)O |
| IUPAC Name | 2-methylpentane-2,4-diol |
| InChI Key | SVTBMSDMJJWYQN-UHFFFAOYNA-N |
| Molecular Formula | C6H14O2 |
3-Amino-1-adamantanol, 96%
CAS: 702-82-9 Molecular Formula: C10H17NO Molecular Weight (g/mol): 167.25 MDL Number: MFCD01821204 InChI Key: DWPIPTNBOVJYAD-UHFFFAOYSA-N Synonym: 3-amino-1-adamantanol,3-amino-1-hydroxyadamantane,1-amino-3-adamantanol,3-amino-adamantanol,1-aminoadamantane-3-ol,3-hydroxy-1-aminoadamantane,1-amino-3-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-1-ol, 3-amino,3-azanyladamantan-1-ol,3-hydroxyadamantane amine PubChem CID: 658645 IUPAC Name: 3-aminoadamantan-1-ol SMILES: C1C2CC3(CC1CC(C2)(C3)O)N
| PubChem CID | 658645 |
|---|---|
| CAS | 702-82-9 |
| Molecular Weight (g/mol) | 167.25 |
| MDL Number | MFCD01821204 |
| SMILES | C1C2CC3(CC1CC(C2)(C3)O)N |
| Synonym | 3-amino-1-adamantanol,3-amino-1-hydroxyadamantane,1-amino-3-adamantanol,3-amino-adamantanol,1-aminoadamantane-3-ol,3-hydroxy-1-aminoadamantane,1-amino-3-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-1-ol, 3-amino,3-azanyladamantan-1-ol,3-hydroxyadamantane amine |
| IUPAC Name | 3-aminoadamantan-1-ol |
| InChI Key | DWPIPTNBOVJYAD-UHFFFAOYSA-N |
| Molecular Formula | C10H17NO |
Ethyl glycolate, 95%
CAS: 623-50-7 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00021970 InChI Key: ZANNOFHADGWOLI-UHFFFAOYSA-N Synonym: ethyl glycolate,ethyl hydroxyacetate,acetic acid, hydroxy-, ethyl ester,glycolic acid, ethyl ester,ethyl glycollate,hydroxyacetic acid ethyl ester,glycolic acid ethyl ester,unii-c306e91wfk,acetic acid, 2-hydroxy-, ethyl ester,2-hydroxyacetic acid ethyl ester PubChem CID: 12184 IUPAC Name: ethyl 2-hydroxyacetate SMILES: CCOC(=O)CO
| PubChem CID | 12184 |
|---|---|
| CAS | 623-50-7 |
| Molecular Weight (g/mol) | 104.11 |
| MDL Number | MFCD00021970 |
| SMILES | CCOC(=O)CO |
| Synonym | ethyl glycolate,ethyl hydroxyacetate,acetic acid, hydroxy-, ethyl ester,glycolic acid, ethyl ester,ethyl glycollate,hydroxyacetic acid ethyl ester,glycolic acid ethyl ester,unii-c306e91wfk,acetic acid, 2-hydroxy-, ethyl ester,2-hydroxyacetic acid ethyl ester |
| IUPAC Name | ethyl 2-hydroxyacetate |
| InChI Key | ZANNOFHADGWOLI-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |
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 |
cis-2-Butene-1,4-diol, 96%, remainder trans-isomer
CAS: 6117-80-2 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.11 MDL Number: MFCD00002924,MFCD00063207 InChI Key: ORTVZLZNOYNASJ-UPHRSURJSA-N Synonym: cis-2-butene-1,4-diol,z-2-butene-1,4-diol,cis-butenediol,unii-za7vgu6scv,cis-1,4-dihydroxy-2-butene,z-but-2-ene-1,4-diol,2-butene-1,4-diol,2z-but-2-ene-1,4-diol,2-butene-1,4-diol, z,za7vgu6scv PubChem CID: 643790 IUPAC Name: (Z)-but-2-ene-1,4-diol SMILES: OC\C=C/CO
| PubChem CID | 643790 |
|---|---|
| CAS | 6117-80-2 |
| Molecular Weight (g/mol) | 88.11 |
| MDL Number | MFCD00002924,MFCD00063207 |
| SMILES | OC\C=C/CO |
| Synonym | cis-2-butene-1,4-diol,z-2-butene-1,4-diol,cis-butenediol,unii-za7vgu6scv,cis-1,4-dihydroxy-2-butene,z-but-2-ene-1,4-diol,2-butene-1,4-diol,2z-but-2-ene-1,4-diol,2-butene-1,4-diol, z,za7vgu6scv |
| IUPAC Name | (Z)-but-2-ene-1,4-diol |
| InChI Key | ORTVZLZNOYNASJ-UPHRSURJSA-N |
| Molecular Formula | C4H8O2 |
Zirconium(IV) tert-butoxide, 97+%, Thermo Scientific Chemicals
CAS: 2081-12-1 Molecular Formula: C16H40O4Zr Molecular Weight (g/mol): 387.72 MDL Number: MFCD00075085 InChI Key: WRMYASGYMABHCC-UHFFFAOYSA-N Synonym: zirconium iv tert-butoxide,2-methylpropan-2-ol; zirconium PubChem CID: 25203936 IUPAC Name: 2-methylpropan-2-ol;zirconium SMILES: CC(C)(C)O.CC(C)(C)O.CC(C)(C)O.CC(C)(C)O.[Zr]
| PubChem CID | 25203936 |
|---|---|
| CAS | 2081-12-1 |
| Molecular Weight (g/mol) | 387.72 |
| MDL Number | MFCD00075085 |
| SMILES | CC(C)(C)O.CC(C)(C)O.CC(C)(C)O.CC(C)(C)O.[Zr] |
| Synonym | zirconium iv tert-butoxide,2-methylpropan-2-ol; zirconium |
| IUPAC Name | 2-methylpropan-2-ol;zirconium |
| InChI Key | WRMYASGYMABHCC-UHFFFAOYSA-N |
| Molecular Formula | C16H40O4Zr |
8-Bromo-1-octanol, 95%
CAS: 50816-19-8 Molecular Formula: C8H17BrO Molecular Weight (g/mol): 209.127 MDL Number: MFCD00010388 InChI Key: GMXIEASXPUEOTG-UHFFFAOYSA-N Synonym: 8-bromo-1-octanol,1-octanol, 8-bromo,8-bromooctanol,octamethylene bromohydrin,8-bromo octanol,1-bromooctan-8-ol,8-bromo-1-actanol,8-bromooctane-1-ol,1-bromo-octan-8-ol,8-bromo-octan-1-ol PubChem CID: 162607 IUPAC Name: 8-bromooctan-1-ol SMILES: C(CCCCBr)CCCO
| PubChem CID | 162607 |
|---|---|
| CAS | 50816-19-8 |
| Molecular Weight (g/mol) | 209.127 |
| MDL Number | MFCD00010388 |
| SMILES | C(CCCCBr)CCCO |
| Synonym | 8-bromo-1-octanol,1-octanol, 8-bromo,8-bromooctanol,octamethylene bromohydrin,8-bromo octanol,1-bromooctan-8-ol,8-bromo-1-actanol,8-bromooctane-1-ol,1-bromo-octan-8-ol,8-bromo-octan-1-ol |
| IUPAC Name | 8-bromooctan-1-ol |
| InChI Key | GMXIEASXPUEOTG-UHFFFAOYSA-N |
| Molecular Formula | C8H17BrO |
5-Norbornene-2-exo,3-exo-dimethanol, 97%
CAS: 699-95-6 Molecular Formula: C9H14O2 Molecular Weight (g/mol): 154.209 MDL Number: MFCD00799568 InChI Key: IGHHPVIMEQGKNE-ROVKLQMOSA-N Synonym: bicyclo 2.2.1 hept-5-ene-2-exo,3-exo-dimethanol PubChem CID: 73995587 IUPAC Name: [(1R,3S,4S)-3-(hydroxymethyl)-2-bicyclo[2.2.1]hept-5-enyl]methanol SMILES: C1C2C=CC1C(C2CO)CO
| PubChem CID | 73995587 |
|---|---|
| CAS | 699-95-6 |
| Molecular Weight (g/mol) | 154.209 |
| MDL Number | MFCD00799568 |
| SMILES | C1C2C=CC1C(C2CO)CO |
| Synonym | bicyclo 2.2.1 hept-5-ene-2-exo,3-exo-dimethanol |
| IUPAC Name | [(1R,3S,4S)-3-(hydroxymethyl)-2-bicyclo[2.2.1]hept-5-enyl]methanol |
| InChI Key | IGHHPVIMEQGKNE-ROVKLQMOSA-N |
| Molecular Formula | C9H14O2 |
1-Chloro-2-methyl-2-propanol, 98%
CAS: 558-42-9 Molecular Formula: C4H9ClO Molecular Weight (g/mol): 108.57 MDL Number: MFCD00021807 InChI Key: JNOZGFXJZQXOSU-UHFFFAOYSA-N Synonym: 1-chloro-2-methyl-2-propanol,chloro-tert-butanol,2-propanol, 1-chloro-2-methyl,1-chloro-tert-butyl alcohol,2-chloro-tert-butyl alcohol,1-chloro-2-methyl-propan-2-ol,pubchem3675,1-chloro-2-isobutanol,acmc-209lpr,chloro-tert-butyl alcohol PubChem CID: 68409 IUPAC Name: 1-chloro-2-methylpropan-2-ol SMILES: CC(C)(O)CCl
| PubChem CID | 68409 |
|---|---|
| CAS | 558-42-9 |
| Molecular Weight (g/mol) | 108.57 |
| MDL Number | MFCD00021807 |
| SMILES | CC(C)(O)CCl |
| Synonym | 1-chloro-2-methyl-2-propanol,chloro-tert-butanol,2-propanol, 1-chloro-2-methyl,1-chloro-tert-butyl alcohol,2-chloro-tert-butyl alcohol,1-chloro-2-methyl-propan-2-ol,pubchem3675,1-chloro-2-isobutanol,acmc-209lpr,chloro-tert-butyl alcohol |
| IUPAC Name | 1-chloro-2-methylpropan-2-ol |
| InChI Key | JNOZGFXJZQXOSU-UHFFFAOYSA-N |
| Molecular Formula | C4H9ClO |
(2-Phenylpyrimidin-5-yl)methanol, 97%, Thermo Scientific™
CAS: 886531-62-0 Molecular Formula: C11H10N2O Molecular Weight (g/mol): 186.214 MDL Number: MFCD09817550 InChI Key: DJEBODXMCJKLPH-UHFFFAOYSA-N Synonym: 2-phenylpyrimidin-5-yl methanol,5-hydroxymethyl-2-phenylpyrimidine,phenyl-5-pyrimidine methanol,5-pyrimidinemethanol,2-phenyl,2-phenylpyrimidin-5-yl methan-1-ol PubChem CID: 21298145 IUPAC Name: (2-phenylpyrimidin-5-yl)methanol SMILES: C1=CC=C(C=C1)C2=NC=C(C=N2)CO
| PubChem CID | 21298145 |
|---|---|
| CAS | 886531-62-0 |
| Molecular Weight (g/mol) | 186.214 |
| MDL Number | MFCD09817550 |
| SMILES | C1=CC=C(C=C1)C2=NC=C(C=N2)CO |
| Synonym | 2-phenylpyrimidin-5-yl methanol,5-hydroxymethyl-2-phenylpyrimidine,phenyl-5-pyrimidine methanol,5-pyrimidinemethanol,2-phenyl,2-phenylpyrimidin-5-yl methan-1-ol |
| IUPAC Name | (2-phenylpyrimidin-5-yl)methanol |
| InChI Key | DJEBODXMCJKLPH-UHFFFAOYSA-N |
| Molecular Formula | C11H10N2O |
3-Methyl-1-butanol, ACS, 98.5+%
CAS: 123-51-3 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00002934 InChI Key: PHTQWCKDNZKARW-UHFFFAOYSA-N Synonym: 3-methyl-1-butanol,isoamyl alcohol,isopentyl alcohol,isopentanol,3-methylbutanol,1-butanol, 3-methyl,isoamylol,isobutylcarbinol,iso-amylalkohol,isobutyl carbinol PubChem CID: 31260 ChEBI: CHEBI:15837 IUPAC Name: 3-methylbutan-1-ol SMILES: CC(C)CCO
| PubChem CID | 31260 |
|---|---|
| CAS | 123-51-3 |
| Molecular Weight (g/mol) | 88.15 |
| ChEBI | CHEBI:15837 |
| MDL Number | MFCD00002934 |
| SMILES | CC(C)CCO |
| Synonym | 3-methyl-1-butanol,isoamyl alcohol,isopentyl alcohol,isopentanol,3-methylbutanol,1-butanol, 3-methyl,isoamylol,isobutylcarbinol,iso-amylalkohol,isobutyl carbinol |
| IUPAC Name | 3-methylbutan-1-ol |
| InChI Key | PHTQWCKDNZKARW-UHFFFAOYSA-N |
| Molecular Formula | C5H12O |
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 |