Organooxygen compounds
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(S)-(+)-1,2-Propanediol 98.0+%, TCI America™
CAS: 4254-15-3 Molecular Formula: C3H8O2 Molecular Weight (g/mol): 76.10 MDL Number: MFCD00004539 InChI Key: DNIAPMSPPWPWGF-UHFFFAOYNA-N Synonym: s-+-1,2-propanediol,s-propane-1,2-diol,s-1,2-propanediol,2s-propane-1,2-diol,s-propylene glycol,s-+-propylene glycol,s-+-1,2-dihydroxypropane,propylene glycol #,pgo PubChem CID: 439846 ChEBI: CHEBI:29002 IUPAC Name: propane-1,2-diol SMILES: CC(O)CO
| PubChem CID | 439846 |
|---|---|
| CAS | 4254-15-3 |
| Molecular Weight (g/mol) | 76.10 |
| ChEBI | CHEBI:29002 |
| MDL Number | MFCD00004539 |
| SMILES | CC(O)CO |
| Synonym | s-+-1,2-propanediol,s-propane-1,2-diol,s-1,2-propanediol,2s-propane-1,2-diol,s-propylene glycol,s-+-propylene glycol,s-+-1,2-dihydroxypropane,propylene glycol #,pgo |
| IUPAC Name | propane-1,2-diol |
| InChI Key | DNIAPMSPPWPWGF-UHFFFAOYNA-N |
| Molecular Formula | C3H8O2 |
1,3-Cyclopentanediol (cis- and trans- mixture) 95.0+%, TCI America™
CAS: 59719-74-3 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00001367 InChI Key: NUUPJBRGQCEZSI-UHFFFAOYSA-N Synonym: 1,3-cyclopentanediol,1,3-cyclopentanediol, cis,1,3-cyclopentanediol, mixture of cis and trans,1,3-cyclopentandiol,1,4-cyclopentanediol,cyclopentan-1,3-diol,3-hydroxy cylcopentanol,cyclopentane 1,3-diol,acmc-20ap4n,1,3-dihydroxycyclopentane PubChem CID: 100165 IUPAC Name: cyclopentane-1,3-diol SMILES: C1CC(CC1O)O
| PubChem CID | 100165 |
|---|---|
| CAS | 59719-74-3 |
| Molecular Weight (g/mol) | 102.133 |
| MDL Number | MFCD00001367 |
| SMILES | C1CC(CC1O)O |
| Synonym | 1,3-cyclopentanediol,1,3-cyclopentanediol, cis,1,3-cyclopentanediol, mixture of cis and trans,1,3-cyclopentandiol,1,4-cyclopentanediol,cyclopentan-1,3-diol,3-hydroxy cylcopentanol,cyclopentane 1,3-diol,acmc-20ap4n,1,3-dihydroxycyclopentane |
| IUPAC Name | cyclopentane-1,3-diol |
| InChI Key | NUUPJBRGQCEZSI-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |
1-Octadecanol 98.0+%, TCI America™
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 |
Pentaethylene Glycol 95.0+%, TCI America™
CAS: 4792-15-8 Molecular Formula: C10H22O6 Molecular Weight (g/mol): 238.28 MDL Number: MFCD00002878 InChI Key: JLFNLZLINWHATN-UHFFFAOYSA-N Synonym: pentaethylene glycol,3,6,9,12-tetraoxatetradecane-1,14-diol,pentaethyleneglycol,pentaglycol,ho ch2ch2o 5h,3,6,9,12-tetraoxatetradocane-1,14-diol,2-2-2-2-2-hydroxyethoxy ethoxy ethoxy ethoxy ethanol,dsstox_cid_7579,dsstox_rid_78510,dsstox_gsid_27579 PubChem CID: 62551 ChEBI: CHEBI:39631 IUPAC Name: 2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethanol SMILES: C(COCCOCCOCCOCCO)O
| PubChem CID | 62551 |
|---|---|
| CAS | 4792-15-8 |
| Molecular Weight (g/mol) | 238.28 |
| ChEBI | CHEBI:39631 |
| MDL Number | MFCD00002878 |
| SMILES | C(COCCOCCOCCOCCO)O |
| Synonym | pentaethylene glycol,3,6,9,12-tetraoxatetradecane-1,14-diol,pentaethyleneglycol,pentaglycol,ho ch2ch2o 5h,3,6,9,12-tetraoxatetradocane-1,14-diol,2-2-2-2-2-hydroxyethoxy ethoxy ethoxy ethoxy ethanol,dsstox_cid_7579,dsstox_rid_78510,dsstox_gsid_27579 |
| IUPAC Name | 2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | JLFNLZLINWHATN-UHFFFAOYSA-N |
| Molecular Formula | C10H22O6 |
trans-4-(tert-Butoxycarbonylamino)cyclohexanol 98.0+%, TCI America™
CAS: 111300-06-2 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 | 111300-06-2 |
| 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 |
1-Pentadecanol 95.0+%, TCI America™
CAS: 629-76-5 Molecular Formula: C15H32O Molecular Weight (g/mol): 228.42 MDL Number: MFCD00004759 InChI Key: REIUXOLGHVXAEO-UHFFFAOYSA-N Synonym: 1-pentadecanol,pentadecyl alcohol,pentadecanol,n-pentadecanol,n-1-pentadecanol,neodol 5,unii-333qva4g2q,dsstox_cid_7270,dsstox_rid_78381,dsstox_gsid_27270 PubChem CID: 12397 ChEBI: CHEBI:77468 IUPAC Name: pentadecan-1-ol SMILES: CCCCCCCCCCCCCCCO
| PubChem CID | 12397 |
|---|---|
| CAS | 629-76-5 |
| Molecular Weight (g/mol) | 228.42 |
| ChEBI | CHEBI:77468 |
| MDL Number | MFCD00004759 |
| SMILES | CCCCCCCCCCCCCCCO |
| Synonym | 1-pentadecanol,pentadecyl alcohol,pentadecanol,n-pentadecanol,n-1-pentadecanol,neodol 5,unii-333qva4g2q,dsstox_cid_7270,dsstox_rid_78381,dsstox_gsid_27270 |
| IUPAC Name | pentadecan-1-ol |
| InChI Key | REIUXOLGHVXAEO-UHFFFAOYSA-N |
| Molecular Formula | C15H32O |
1-Phenyl-3-buten-1-ol 97.0+%, TCI America™
CAS: 936-58-3 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00039617 InChI Key: RGKVZBXSJFAZRE-UHFFFAOYSA-N Synonym: 1-phenyl-3-buten-1-ol,4-phenyl-1-buten-4-ol,1-phenyl-but-3-en-1-ol,acmc-1bdtt,upenn_abs_025,1-phenyl-3-buten-1-ol #,benzenemethanol,a-2-propen-1-yl,benzenemethanol, .alpha.-2-propenyl PubChem CID: 220119 IUPAC Name: 1-phenylbut-3-en-1-ol SMILES: C=CCC(C1=CC=CC=C1)O
| PubChem CID | 220119 |
|---|---|
| CAS | 936-58-3 |
| Molecular Weight (g/mol) | 148.205 |
| MDL Number | MFCD00039617 |
| SMILES | C=CCC(C1=CC=CC=C1)O |
| Synonym | 1-phenyl-3-buten-1-ol,4-phenyl-1-buten-4-ol,1-phenyl-but-3-en-1-ol,acmc-1bdtt,upenn_abs_025,1-phenyl-3-buten-1-ol #,benzenemethanol,a-2-propen-1-yl,benzenemethanol, .alpha.-2-propenyl |
| IUPAC Name | 1-phenylbut-3-en-1-ol |
| InChI Key | RGKVZBXSJFAZRE-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
(1R,2R)-2-Aminocyclopentanol Hydrochloride 98.0+%, TCI America™
CAS: 68327-11-7 Molecular Formula: C5H12ClNO Molecular Weight (g/mol): 137.607 MDL Number: MFCD09834692 InChI Key: ZFSXKSSWYSZPGQ-TYSVMGFPSA-N Synonym: (1R,2R)-2-Amino-1-hydroxycyclopentane Hydrochloride PubChem CID: 12886906 IUPAC Name: (1R,2R)-2-aminocyclopentan-1-ol;hydrochloride SMILES: C1CC(C(C1)O)N.Cl
| PubChem CID | 12886906 |
|---|---|
| CAS | 68327-11-7 |
| Molecular Weight (g/mol) | 137.607 |
| MDL Number | MFCD09834692 |
| SMILES | C1CC(C(C1)O)N.Cl |
| Synonym | (1R,2R)-2-Amino-1-hydroxycyclopentane Hydrochloride |
| IUPAC Name | (1R,2R)-2-aminocyclopentan-1-ol;hydrochloride |
| InChI Key | ZFSXKSSWYSZPGQ-TYSVMGFPSA-N |
| Molecular Formula | C5H12ClNO |
4-Sulfocalix[4]arene Hydrate 94.0+%, TCI America™
CAS: 112269-92-8 Molecular Formula: C28H24O16S4 Molecular Weight (g/mol): 744.724 MDL Number: MFCD03095486 InChI Key: JFYBCAFLVNKHHG-UHFFFAOYSA-N Synonym: Tetrahydroxycalix[4]arenetetrasulfonic Acid, Tetrasulfo(tetrahydroxy)calix[4]arene PubChem CID: 644084 SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=C(C(=CC(=C4)S(=O)(=O)O)CC5=C(C1=CC(=C5)S(=O)(=O)O)O)O)S(=O)(=O)O)S(=O)(=O)O
| PubChem CID | 644084 |
|---|---|
| CAS | 112269-92-8 |
| Molecular Weight (g/mol) | 744.724 |
| MDL Number | MFCD03095486 |
| SMILES | C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=C(C(=CC(=C4)S(=O)(=O)O)CC5=C(C1=CC(=C5)S(=O)(=O)O)O)O)S(=O)(=O)O)S(=O)(=O)O |
| Synonym | Tetrahydroxycalix[4]arenetetrasulfonic Acid, Tetrasulfo(tetrahydroxy)calix[4]arene |
| InChI Key | JFYBCAFLVNKHHG-UHFFFAOYSA-N |
| Molecular Formula | C28H24O16S4 |
2-(2,4-Dichlorophenyl)ethanol 97.0+%, TCI America™
CAS: 81156-68-5 Molecular Formula: C8H8Cl2O Molecular Weight (g/mol): 191.051 MDL Number: MFCD00192010 InChI Key: JIJGKPVJAALUQQ-UHFFFAOYSA-N Synonym: 2,4-dichlorophenethyl alcohol,2-2,4-dichlorophenyl ethanol,2,4-dichlorophenethylalcohol,2-2,4-dichlorophenyl ethan-1-ol,2,4-dichlorobenzeneethanol,acmc-209pku,ksc450o3l,2,4-dichlorophenylmethyl-carbinol,2-2,4-dichlorophenyl-ethanol PubChem CID: 2734099 IUPAC Name: 2-(2,4-dichlorophenyl)ethanol SMILES: C1=CC(=C(C=C1Cl)Cl)CCO
| PubChem CID | 2734099 |
|---|---|
| CAS | 81156-68-5 |
| Molecular Weight (g/mol) | 191.051 |
| MDL Number | MFCD00192010 |
| SMILES | C1=CC(=C(C=C1Cl)Cl)CCO |
| Synonym | 2,4-dichlorophenethyl alcohol,2-2,4-dichlorophenyl ethanol,2,4-dichlorophenethylalcohol,2-2,4-dichlorophenyl ethan-1-ol,2,4-dichlorobenzeneethanol,acmc-209pku,ksc450o3l,2,4-dichlorophenylmethyl-carbinol,2-2,4-dichlorophenyl-ethanol |
| IUPAC Name | 2-(2,4-dichlorophenyl)ethanol |
| InChI Key | JIJGKPVJAALUQQ-UHFFFAOYSA-N |
| Molecular Formula | C8H8Cl2O |
1-Adamantanemethanol 99.0+%, TCI America™
CAS: 770-71-8 Molecular Formula: C11H18O Molecular Weight (g/mol): 166.264 MDL Number: MFCD00074751 InChI Key: MDVGOOIANLZFCP-UHFFFAOYSA-N Synonym: 1-adamantanemethanol,adamantan-1-ylmethanol,1-adamantane methanol,1-hydroxymethyl adamantane,adamantane-1-methanol,adamantan-1-yl-methanol,1-hydroxymethyladamantane,tricyclo 3.3.1.1'3,7 dec-1-ylmethanol,adamantan-1-yl methanol,tricyclo 3.3.1.13,7 decanemethanol PubChem CID: 64556 IUPAC Name: 1-adamantylmethanol SMILES: C1C2CC3CC1CC(C2)(C3)CO
| PubChem CID | 64556 |
|---|---|
| CAS | 770-71-8 |
| Molecular Weight (g/mol) | 166.264 |
| MDL Number | MFCD00074751 |
| SMILES | C1C2CC3CC1CC(C2)(C3)CO |
| Synonym | 1-adamantanemethanol,adamantan-1-ylmethanol,1-adamantane methanol,1-hydroxymethyl adamantane,adamantane-1-methanol,adamantan-1-yl-methanol,1-hydroxymethyladamantane,tricyclo 3.3.1.1'3,7 dec-1-ylmethanol,adamantan-1-yl methanol,tricyclo 3.3.1.13,7 decanemethanol |
| IUPAC Name | 1-adamantylmethanol |
| InChI Key | MDVGOOIANLZFCP-UHFFFAOYSA-N |
| Molecular Formula | C11H18O |
Trimethylolethane 98.0+%, TCI America™
CAS: 77-85-0 Molecular Formula: C5H12O3 Molecular Weight (g/mol): 120.148 MDL Number: MFCD00004687 InChI Key: QXJQHYBHAIHNGG-UHFFFAOYSA-N Synonym: trimethylolethane,1,1,1-tris hydroxymethyl ethane,trimet,methriol,metriol,pentaglycerine,pentaglycerol,methyltrimethanolmethane,2-hydroxymethyl-2-methylpropane-1,3-diol,tris hydroxymethyl ethane PubChem CID: 6502 IUPAC Name: 2-(hydroxymethyl)-2-methylpropane-1,3-diol SMILES: CC(CO)(CO)CO
| PubChem CID | 6502 |
|---|---|
| CAS | 77-85-0 |
| Molecular Weight (g/mol) | 120.148 |
| MDL Number | MFCD00004687 |
| SMILES | CC(CO)(CO)CO |
| Synonym | trimethylolethane,1,1,1-tris hydroxymethyl ethane,trimet,methriol,metriol,pentaglycerine,pentaglycerol,methyltrimethanolmethane,2-hydroxymethyl-2-methylpropane-1,3-diol,tris hydroxymethyl ethane |
| IUPAC Name | 2-(hydroxymethyl)-2-methylpropane-1,3-diol |
| InChI Key | QXJQHYBHAIHNGG-UHFFFAOYSA-N |
| Molecular Formula | C5H12O3 |
4-(Hydroxymethyl)cyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 13380-84-2 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.20 MDL Number: MFCD10566907,MFCD01734677,MFCD10566906 InChI Key: VQMIUUBKKPIDBN-UHFFFAOYSA-N Synonym: 4-Carboxy-1-cyclohexanemethanol PubChem CID: 202819 IUPAC Name: 4-(hydroxymethyl)cyclohexane-1-carboxylic acid SMILES: OCC1CCC(CC1)C(O)=O
| PubChem CID | 202819 |
|---|---|
| CAS | 13380-84-2 |
| Molecular Weight (g/mol) | 158.20 |
| MDL Number | MFCD10566907,MFCD01734677,MFCD10566906 |
| SMILES | OCC1CCC(CC1)C(O)=O |
| Synonym | 4-Carboxy-1-cyclohexanemethanol |
| IUPAC Name | 4-(hydroxymethyl)cyclohexane-1-carboxylic acid |
| InChI Key | VQMIUUBKKPIDBN-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
1-(2-Hydroxyethyl)pyrrole 99.0+%, TCI America™
CAS: 6719-02-4 Molecular Formula: C6H9NO Molecular Weight (g/mol): 111.14 MDL Number: MFCD00191451 InChI Key: ZIOLCZCJJJNOEJ-UHFFFAOYSA-N PubChem CID: 10975438 IUPAC Name: 2-pyrrol-1-ylethanol SMILES: C1=CN(C=C1)CCO
| PubChem CID | 10975438 |
|---|---|
| CAS | 6719-02-4 |
| Molecular Weight (g/mol) | 111.14 |
| MDL Number | MFCD00191451 |
| SMILES | C1=CN(C=C1)CCO |
| IUPAC Name | 2-pyrrol-1-ylethanol |
| InChI Key | ZIOLCZCJJJNOEJ-UHFFFAOYSA-N |
| Molecular Formula | C6H9NO |
(R)-1,2-Butanediol 98.0+%, TCI America™
CAS: 40348-66-1 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.12 MDL Number: MFCD09953765 InChI Key: BMRWNKZVCUKKSR-UHFFFAOYNA-N Synonym: (R)-1,2-Butylene Glycol, (R)-1,2-Dihydroxybutane PubChem CID: 641012 ChEBI: CHEBI:52685 IUPAC Name: butane-1,2-diol SMILES: CCC(O)CO
| PubChem CID | 641012 |
|---|---|
| CAS | 40348-66-1 |
| Molecular Weight (g/mol) | 90.12 |
| ChEBI | CHEBI:52685 |
| MDL Number | MFCD09953765 |
| SMILES | CCC(O)CO |
| Synonym | (R)-1,2-Butylene Glycol, (R)-1,2-Dihydroxybutane |
| IUPAC Name | butane-1,2-diol |
| InChI Key | BMRWNKZVCUKKSR-UHFFFAOYNA-N |
| Molecular Formula | C4H10O2 |