Organooxygen compounds
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(S)-1,2-Butanediol 98.0+%, TCI America™
CAS: 73522-17-5 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 MDL Number: MFCD09953764 InChI Key: BMRWNKZVCUKKSR-BYPYZUCNSA-N Synonym: (S)-1,2-Butylene Glycol, (S)-1,2-Dihydroxybutane PubChem CID: 6993189 ChEBI: CHEBI:52686 IUPAC Name: (2S)-butane-1,2-diol SMILES: CCC(CO)O
| PubChem CID | 6993189 |
|---|---|
| CAS | 73522-17-5 |
| Molecular Weight (g/mol) | 90.122 |
| ChEBI | CHEBI:52686 |
| MDL Number | MFCD09953764 |
| SMILES | CCC(CO)O |
| Synonym | (S)-1,2-Butylene Glycol, (S)-1,2-Dihydroxybutane |
| IUPAC Name | (2S)-butane-1,2-diol |
| InChI Key | BMRWNKZVCUKKSR-BYPYZUCNSA-N |
| Molecular Formula | C4H10O2 |
4,4,5,5,5-Pentafluoro-1-pentanol 93.0+%, TCI America™
CAS: 148043-73-6 Molecular Formula: C5H7F5O Molecular Weight (g/mol): 178.102 MDL Number: MFCD00153224 InChI Key: QROUUECTKRZFHF-UHFFFAOYSA-N Synonym: 4,4,5,5,5-pentafluoro-1-pentanol,4,4,5,5,5-pentafluoropentanol,pentafluoropentanol,1-pentanol, 4,4,5,5,5-pentafluoro,fulvestrant intermediate,acmc-1bz8x,3-perfluoroethyl propan-1-ol,4,4,5,5,5-pentafluoro pentanol,4,4,5,5,5-pentafluoro-pentanol,4,4,5,5,5-pentafluorpentan-1-ol PubChem CID: 547967 IUPAC Name: 4,4,5,5,5-pentafluoropentan-1-ol SMILES: C(CC(C(F)(F)F)(F)F)CO
| PubChem CID | 547967 |
|---|---|
| CAS | 148043-73-6 |
| Molecular Weight (g/mol) | 178.102 |
| MDL Number | MFCD00153224 |
| SMILES | C(CC(C(F)(F)F)(F)F)CO |
| Synonym | 4,4,5,5,5-pentafluoro-1-pentanol,4,4,5,5,5-pentafluoropentanol,pentafluoropentanol,1-pentanol, 4,4,5,5,5-pentafluoro,fulvestrant intermediate,acmc-1bz8x,3-perfluoroethyl propan-1-ol,4,4,5,5,5-pentafluoro pentanol,4,4,5,5,5-pentafluoro-pentanol,4,4,5,5,5-pentafluorpentan-1-ol |
| IUPAC Name | 4,4,5,5,5-pentafluoropentan-1-ol |
| InChI Key | QROUUECTKRZFHF-UHFFFAOYSA-N |
| Molecular Formula | C5H7F5O |
(S)-4-(2-Hydroxyethyl)-2,2-diisopropyl-1,3-dioxolane 95.0+%, TCI America™
CAS: 151223-12-0 Molecular Formula: C11H22O3 Molecular Weight (g/mol): 202.294 InChI Key: XFPZNMFFBDUEGH-JTQLQIEISA-N Synonym: (S)-2-(2,2-Diisopropyl-1,3-dioxolan-4-yl)ethanol PubChem CID: 54467051 IUPAC Name: 2-[(4S)-2,2-di(propan-2-yl)-1,3-dioxolan-4-yl]ethanol SMILES: CC(C)C1(OCC(O1)CCO)C(C)C
| PubChem CID | 54467051 |
|---|---|
| CAS | 151223-12-0 |
| Molecular Weight (g/mol) | 202.294 |
| SMILES | CC(C)C1(OCC(O1)CCO)C(C)C |
| Synonym | (S)-2-(2,2-Diisopropyl-1,3-dioxolan-4-yl)ethanol |
| IUPAC Name | 2-[(4S)-2,2-di(propan-2-yl)-1,3-dioxolan-4-yl]ethanol |
| InChI Key | XFPZNMFFBDUEGH-JTQLQIEISA-N |
| Molecular Formula | C11H22O3 |
3,4-Dimethyl-3-hexanol 99.0+%, TCI America™
CAS: 19550-08-4 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.231 MDL Number: MFCD00021820 InChI Key: FJXOYCIYKQJAAF-UHFFFAOYSA-N PubChem CID: 140548 IUPAC Name: 3,4-dimethylhexan-3-ol SMILES: CCC(C)C(C)(CC)O
| PubChem CID | 140548 |
|---|---|
| CAS | 19550-08-4 |
| Molecular Weight (g/mol) | 130.231 |
| MDL Number | MFCD00021820 |
| SMILES | CCC(C)C(C)(CC)O |
| IUPAC Name | 3,4-dimethylhexan-3-ol |
| InChI Key | FJXOYCIYKQJAAF-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |
1-Naphthalenemethanol 95.0+%, TCI America™
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-yl)methanol 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-yl)methanol |
| InChI Key | PBLNHHSDYFYZNC-UHFFFAOYSA-N |
| Molecular Formula | C11H10O |
(R,R)-(+)-Hydrobenzoin 99.0+%, TCI America™
CAS: 52340-78-0 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.264 MDL Number: MFCD00064254 InChI Key: IHPDTPWNFBQHEB-ZIAGYGMSSA-N Synonym: r,r-+-hydrobenzoin,1r,2r-1,2-diphenylethane-1,2-diol,r,r-hydrobenzoin,+-hydrobenzoin,unii-wv0i33nond,+-1r,2r-1,2-diphenylethane-1,2-diol,wv0i33nond,isohydrobenzoin,1,2-ethanediol, 1,2-diphenyl-, 1r,2r-rel,+-dihydrobenzoin PubChem CID: 853019 ChEBI: CHEBI:50014 IUPAC Name: (1R,2R)-1,2-diphenylethane-1,2-diol SMILES: C1=CC=C(C=C1)C(C(C2=CC=CC=C2)O)O
| PubChem CID | 853019 |
|---|---|
| CAS | 52340-78-0 |
| Molecular Weight (g/mol) | 214.264 |
| ChEBI | CHEBI:50014 |
| MDL Number | MFCD00064254 |
| SMILES | C1=CC=C(C=C1)C(C(C2=CC=CC=C2)O)O |
| Synonym | r,r-+-hydrobenzoin,1r,2r-1,2-diphenylethane-1,2-diol,r,r-hydrobenzoin,+-hydrobenzoin,unii-wv0i33nond,+-1r,2r-1,2-diphenylethane-1,2-diol,wv0i33nond,isohydrobenzoin,1,2-ethanediol, 1,2-diphenyl-, 1r,2r-rel,+-dihydrobenzoin |
| IUPAC Name | (1R,2R)-1,2-diphenylethane-1,2-diol |
| InChI Key | IHPDTPWNFBQHEB-ZIAGYGMSSA-N |
| Molecular Formula | C14H14O2 |
8-Chloro-1-n-octanol 97.0+%, TCI America™
CAS: 23144-52-7 Molecular Formula: C8H17ClO Molecular Weight (g/mol): 164.673 MDL Number: MFCD00040005 InChI Key: YDFAJMDFCCJZSI-UHFFFAOYSA-N Synonym: 8-chloro-1-octanol,1-octanol, 8-chloro,8-chlorooctanol,8-chloro-octan-1-ol,8-chloro-1-n-octanol,8-chlor-1-octanol,8-chlor-octan-1-ol,acmc-1cr4x PubChem CID: 90012 IUPAC Name: 8-chlorooctan-1-ol SMILES: C(CCCCCl)CCCO
| PubChem CID | 90012 |
|---|---|
| CAS | 23144-52-7 |
| Molecular Weight (g/mol) | 164.673 |
| MDL Number | MFCD00040005 |
| SMILES | C(CCCCCl)CCCO |
| Synonym | 8-chloro-1-octanol,1-octanol, 8-chloro,8-chlorooctanol,8-chloro-octan-1-ol,8-chloro-1-n-octanol,8-chlor-1-octanol,8-chlor-octan-1-ol,acmc-1cr4x |
| IUPAC Name | 8-chlorooctan-1-ol |
| InChI Key | YDFAJMDFCCJZSI-UHFFFAOYSA-N |
| Molecular Formula | C8H17ClO |
meso-alpha,beta-Di(4-pyridyl) Glycol 98.0+%, TCI America™
CAS: 4972-49-0 Molecular Formula: C12H12N2O2 Molecular Weight (g/mol): 216.24 MDL Number: MFCD00023627 InChI Key: DHKSJSQSVHHBPH-TXEJJXNPSA-N Synonym: meso-1,2-Bis(4-pyridyl) Glycol, meso-1,2-Di(4-pyridyl) Glycol, meso-1,2-Di(4-pyridyl)-1,2-ethanediol PubChem CID: 12785626 IUPAC Name: (1R,2S)-1,2-dipyridin-4-ylethane-1,2-diol SMILES: C1=CN=CC=C1C(C(C2=CC=NC=C2)O)O
| PubChem CID | 12785626 |
|---|---|
| CAS | 4972-49-0 |
| Molecular Weight (g/mol) | 216.24 |
| MDL Number | MFCD00023627 |
| SMILES | C1=CN=CC=C1C(C(C2=CC=NC=C2)O)O |
| Synonym | meso-1,2-Bis(4-pyridyl) Glycol, meso-1,2-Di(4-pyridyl) Glycol, meso-1,2-Di(4-pyridyl)-1,2-ethanediol |
| IUPAC Name | (1R,2S)-1,2-dipyridin-4-ylethane-1,2-diol |
| InChI Key | DHKSJSQSVHHBPH-TXEJJXNPSA-N |
| Molecular Formula | C12H12N2O2 |
(S)-4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane 95.0+%, TCI America™
CAS: 32233-43-5 Molecular Formula: C7H14O3 Molecular Weight (g/mol): 146.186 MDL Number: MFCD02682967 InChI Key: YYEZYENJAMOWHW-ZCFIWIBFSA-N Synonym: (S)-2-(2,2-Dimethyl-1,3-dioxolan-4-yl)ethanol PubChem CID: 11480522 IUPAC Name: 2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanol SMILES: CC1(OCC(O1)CCO)C
| PubChem CID | 11480522 |
|---|---|
| CAS | 32233-43-5 |
| Molecular Weight (g/mol) | 146.186 |
| MDL Number | MFCD02682967 |
| SMILES | CC1(OCC(O1)CCO)C |
| Synonym | (S)-2-(2,2-Dimethyl-1,3-dioxolan-4-yl)ethanol |
| IUPAC Name | 2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanol |
| InChI Key | YYEZYENJAMOWHW-ZCFIWIBFSA-N |
| Molecular Formula | C7H14O3 |
cis-4-Hydroxycyclohexanecarboxylic Acid 98.0+%, TCI America™
CAS: 3685-22-1 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD04038017 InChI Key: HCFRWBBJISAZNK-UHFFFAOYSA-N PubChem CID: 151138 IUPAC Name: 4-hydroxycyclohexane-1-carboxylic acid SMILES: C1CC(CCC1C(=O)O)O
| PubChem CID | 151138 |
|---|---|
| CAS | 3685-22-1 |
| Molecular Weight (g/mol) | 144.17 |
| MDL Number | MFCD04038017 |
| SMILES | C1CC(CCC1C(=O)O)O |
| IUPAC Name | 4-hydroxycyclohexane-1-carboxylic acid |
| InChI Key | HCFRWBBJISAZNK-UHFFFAOYSA-N |
| Molecular Formula | C7H12O3 |
2,6-Dimethylcyclohexanol (mixture of isomers) 99.0+%, TCI America™
CAS: 5337-72-4 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.215 MDL Number: MFCD00001502 InChI Key: MOISVRZIQDQVPF-UHFFFAOYSA-N Synonym: 2,6-dimethylcyclohexanol,cyclohexanol, 2,6-dimethyl,2,6-dimethylcyclohexyl alcohol,ambsclk-255,cyclohexanol,6-dimethyl,2,6-dimethyl-cyclohexanol,acmc-20ao81,2,6-dimethylcyclohexanol,c&t,2,6-dimethyl-cyclohexan-1-ol,2,6-dimethylcyclohexanol, mixture of isomers PubChem CID: 21428 IUPAC Name: 2,6-dimethylcyclohexan-1-ol SMILES: CC1CCCC(C1O)C
| PubChem CID | 21428 |
|---|---|
| CAS | 5337-72-4 |
| Molecular Weight (g/mol) | 128.215 |
| MDL Number | MFCD00001502 |
| SMILES | CC1CCCC(C1O)C |
| Synonym | 2,6-dimethylcyclohexanol,cyclohexanol, 2,6-dimethyl,2,6-dimethylcyclohexyl alcohol,ambsclk-255,cyclohexanol,6-dimethyl,2,6-dimethyl-cyclohexanol,acmc-20ao81,2,6-dimethylcyclohexanol,c&t,2,6-dimethyl-cyclohexan-1-ol,2,6-dimethylcyclohexanol, mixture of isomers |
| IUPAC Name | 2,6-dimethylcyclohexan-1-ol |
| InChI Key | MOISVRZIQDQVPF-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
Guaiacylglycerol-beta-guaiacyl Ether 97.0+%, TCI America™
CAS: 7382-59-4 Molecular Formula: C17H20O6 Molecular Weight (g/mol): 320.34 MDL Number: MFCD00060144 InChI Key: COXIJIHARCXZBW-UHFFFAOYNA-N Synonym: 1-(4-Hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)-1,3-propanediol PubChem CID: 6424189 ChEBI: CHEBI:53650 IUPAC Name: 4-[1-hydroxy-2-(hydroxymethoxy)-2-(2-methoxyphenyl)ethyl]-2-methoxyphenol SMILES: COC1=CC(=CC=C1O)C(O)C(OCO)C1=CC=CC=C1OC
| PubChem CID | 6424189 |
|---|---|
| CAS | 7382-59-4 |
| Molecular Weight (g/mol) | 320.34 |
| ChEBI | CHEBI:53650 |
| MDL Number | MFCD00060144 |
| SMILES | COC1=CC(=CC=C1O)C(O)C(OCO)C1=CC=CC=C1OC |
| Synonym | 1-(4-Hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)-1,3-propanediol |
| IUPAC Name | 4-[1-hydroxy-2-(hydroxymethoxy)-2-(2-methoxyphenyl)ethyl]-2-methoxyphenol |
| InChI Key | COXIJIHARCXZBW-UHFFFAOYNA-N |
| Molecular Formula | C17H20O6 |
4-Sulfocalix[6]arene Hydrate 95.0+%, TCI America™
CAS: 102088-39-1 Molecular Formula: C42H36O24S6 Molecular Weight (g/mol): 1117.09 MDL Number: MFCD00216907,MFCD00143376 InChI Key: BXOUPTJVBGEDIR-UHFFFAOYSA-N Synonym: 4-sulfocalix 6 arene,4-sulfocalix 6 arene hydrate,hexahydroxycalix 6 arenehexasulfonic acid,4-sulfonic calix 6 arene,acmc-20m53e,calix 6 arene-p-sulfonate,hexasulfo hexahydroxy calix 6 arene PubChem CID: 2724887 IUPAC Name: 37,38,39,40,41,42-hexahydroxyheptacyclo[31.3.1.1³,⁷.1⁹,¹³.1¹⁵,¹⁹.1²¹,²⁵.1²⁷,³¹]dotetraconta-1(37),3,5,7(42),9,11,13(41),15(40),16,18,21(39),22,24,27(38),28,30,33,35-octadecaene-5,11,17,23,29,35-hexasulfonic acid SMILES: OC1=C2CC3=CC(=CC(CC4=CC(=CC(CC5=C(O)C(CC6=C(O)C(CC7=C(O)C(CC1=CC(=C2)S(O)(=O)=O)=CC(=C7)S(O)(=O)=O)=CC(=C6)S(O)(=O)=O)=CC(=C5)S(O)(=O)=O)=C4O)S(O)(=O)=O)=C3O)S(O)(=O)=O
| PubChem CID | 2724887 |
|---|---|
| CAS | 102088-39-1 |
| Molecular Weight (g/mol) | 1117.09 |
| MDL Number | MFCD00216907,MFCD00143376 |
| SMILES | OC1=C2CC3=CC(=CC(CC4=CC(=CC(CC5=C(O)C(CC6=C(O)C(CC7=C(O)C(CC1=CC(=C2)S(O)(=O)=O)=CC(=C7)S(O)(=O)=O)=CC(=C6)S(O)(=O)=O)=CC(=C5)S(O)(=O)=O)=C4O)S(O)(=O)=O)=C3O)S(O)(=O)=O |
| Synonym | 4-sulfocalix 6 arene,4-sulfocalix 6 arene hydrate,hexahydroxycalix 6 arenehexasulfonic acid,4-sulfonic calix 6 arene,acmc-20m53e,calix 6 arene-p-sulfonate,hexasulfo hexahydroxy calix 6 arene |
| IUPAC Name | 37,38,39,40,41,42-hexahydroxyheptacyclo[31.3.1.1³,⁷.1⁹,¹³.1¹⁵,¹⁹.1²¹,²⁵.1²⁷,³¹]dotetraconta-1(37),3,5,7(42),9,11,13(41),15(40),16,18,21(39),22,24,27(38),28,30,33,35-octadecaene-5,11,17,23,29,35-hexasulfonic acid |
| InChI Key | BXOUPTJVBGEDIR-UHFFFAOYSA-N |
| Molecular Formula | C42H36O24S6 |
2-(Hydroxymethyl)thiazole 98.0+%, TCI America™
CAS: 14542-12-2 Molecular Formula: C4H5NOS Molecular Weight (g/mol): 115.15 MDL Number: MFCD06200855 InChI Key: JNHDLNXNYPLBMJ-UHFFFAOYSA-N Synonym: thiazol-2-ylmethanol,2-thiazolemethanol,thiazol-2-yl-methanol,2-hydroxymethylthiazole,2-hydroxymethyl thiazole,2-hydroxymehtylthiazole,1,3-thiazol-2-yl methanol,thiazol-2-yl methanol,thiazole-2-methanol,2-thiazolylmethanol PubChem CID: 2795213 IUPAC Name: (1,3-thiazol-2-yl)methanol SMILES: OCC1=NC=CS1
| PubChem CID | 2795213 |
|---|---|
| CAS | 14542-12-2 |
| Molecular Weight (g/mol) | 115.15 |
| MDL Number | MFCD06200855 |
| SMILES | OCC1=NC=CS1 |
| Synonym | thiazol-2-ylmethanol,2-thiazolemethanol,thiazol-2-yl-methanol,2-hydroxymethylthiazole,2-hydroxymethyl thiazole,2-hydroxymehtylthiazole,1,3-thiazol-2-yl methanol,thiazol-2-yl methanol,thiazole-2-methanol,2-thiazolylmethanol |
| IUPAC Name | (1,3-thiazol-2-yl)methanol |
| InChI Key | JNHDLNXNYPLBMJ-UHFFFAOYSA-N |
| Molecular Formula | C4H5NOS |