Organooxygen compounds
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2-Ethylcyclohexanol (cis- and trans- mixture) 97.0+%, TCI America™
CAS: 3760-20-1 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.215 MDL Number: MFCD00001445 InChI Key: CFYUBZHJDXXXQE-UHFFFAOYSA-N PubChem CID: 19576 IUPAC Name: 2-ethylcyclohexan-1-ol SMILES: CCC1CCCCC1O
| PubChem CID | 19576 |
|---|---|
| CAS | 3760-20-1 |
| Molecular Weight (g/mol) | 128.215 |
| MDL Number | MFCD00001445 |
| SMILES | CCC1CCCCC1O |
| IUPAC Name | 2-ethylcyclohexan-1-ol |
| InChI Key | CFYUBZHJDXXXQE-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
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 |
1,1-Bis(hydroxymethyl)cyclopropane 96.0+%, TCI America™
CAS: 39590-81-3 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00464207 InChI Key: YAINYZJQSQEGND-UHFFFAOYSA-N Synonym: 1,1-bis hydroxymethyl cyclopropane,1-hydroxymethyl cyclopropyl methanol,1-hydroxymethylcyclopropyl methanol,1,1-cyclopropanedimethanol,cyclopropane-1,1-diyldimethanol,1,1-dimetholcyclopropane,1,1-cyclopropyldimethanol,cyclopropanedimethanol,pubchem15258,acmc-209j6f PubChem CID: 4101437 IUPAC Name: [1-(hydroxymethyl)cyclopropyl]methanol SMILES: C1CC1(CO)CO
| PubChem CID | 4101437 |
|---|---|
| CAS | 39590-81-3 |
| Molecular Weight (g/mol) | 102.133 |
| MDL Number | MFCD00464207 |
| SMILES | C1CC1(CO)CO |
| Synonym | 1,1-bis hydroxymethyl cyclopropane,1-hydroxymethyl cyclopropyl methanol,1-hydroxymethylcyclopropyl methanol,1,1-cyclopropanedimethanol,cyclopropane-1,1-diyldimethanol,1,1-dimetholcyclopropane,1,1-cyclopropyldimethanol,cyclopropanedimethanol,pubchem15258,acmc-209j6f |
| IUPAC Name | [1-(hydroxymethyl)cyclopropyl]methanol |
| InChI Key | YAINYZJQSQEGND-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |
2,2'-Bipyridine, 1% (w/v) in Methanol, Ricca Chemical
CAS: 67-56-1 Molecular Formula: CH4O Molecular Weight (g/mol): Mixture MDL Number: MFCD00004595 InChI Key: OKKJLVBELUTLKV-UHFFFAOYSA-N Synonym: methyl alcohol,wood alcohol,carbinol,wood spirit,wood naphtha,methylol,methyl hydroxide,pyroxylic spirit,colonial spirit,columbian spirit IUPAC Name: methanol SMILES: CO
| CAS | 67-56-1 |
|---|---|
| Molecular Weight (g/mol) | Mixture |
| MDL Number | MFCD00004595 |
| SMILES | CO |
| Synonym | methyl alcohol,wood alcohol,carbinol,wood spirit,wood naphtha,methylol,methyl hydroxide,pyroxylic spirit,colonial spirit,columbian spirit |
| IUPAC Name | methanol |
| InChI Key | OKKJLVBELUTLKV-UHFFFAOYSA-N |
| Molecular Formula | CH4O |
(S)-(+)-3-Hydroxy-2,2-dimethylcyclohexanone 95.0+%, TCI America™
CAS: 87655-21-8 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00671542 InChI Key: MAGFJLNBFXFQGX-LURJTMIESA-N PubChem CID: 11018979 IUPAC Name: (3S)-3-hydroxy-2,2-dimethylcyclohexan-1-one SMILES: CC1(C(CCCC1=O)O)C
| PubChem CID | 11018979 |
|---|---|
| CAS | 87655-21-8 |
| Molecular Weight (g/mol) | 142.198 |
| MDL Number | MFCD00671542 |
| SMILES | CC1(C(CCCC1=O)O)C |
| IUPAC Name | (3S)-3-hydroxy-2,2-dimethylcyclohexan-1-one |
| InChI Key | MAGFJLNBFXFQGX-LURJTMIESA-N |
| Molecular Formula | C8H14O2 |
Heptaethylene Glycol Monomethyl Ether 97.0+%, TCI America™
CAS: 4437-01-8 Molecular Formula: C15H32O8 Molecular Weight (g/mol): 340.41 MDL Number: MFCD06201006 InChI Key: AGWKUHGLWHMYTG-UHFFFAOYSA-N Synonym: mPEG7-Alcohol PubChem CID: 526555 IUPAC Name: 2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol SMILES: COCCOCCOCCOCCOCCOCCOCCO
| PubChem CID | 526555 |
|---|---|
| CAS | 4437-01-8 |
| Molecular Weight (g/mol) | 340.41 |
| MDL Number | MFCD06201006 |
| SMILES | COCCOCCOCCOCCOCCOCCOCCO |
| Synonym | mPEG7-Alcohol |
| IUPAC Name | 2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | AGWKUHGLWHMYTG-UHFFFAOYSA-N |
| Molecular Formula | C15H32O8 |
Ethyl DL-Mandelate 95.0+%, TCI America™
CAS: 774-40-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00004494 InChI Key: SAXHIDRUJXPDOD-UHFFFAOYSA-N Synonym: ethyl mandelate,ethyl phenylglycolate,mandelic acid, ethyl ester,dl-mandelic acid ethyl ester,mandelic acid ethyl ester,ethyl dl-mandelate,mandelsaeureaethylester,ethyl hydroxy phenyl acetate,mandelsaeureaethylester german,+-ethyl mandelate PubChem CID: 13050 ChEBI: CHEBI:38750 IUPAC Name: ethyl 2-hydroxy-2-phenylacetate SMILES: CCOC(=O)C(C1=CC=CC=C1)O
| PubChem CID | 13050 |
|---|---|
| CAS | 774-40-3 |
| Molecular Weight (g/mol) | 180.203 |
| ChEBI | CHEBI:38750 |
| MDL Number | MFCD00004494 |
| SMILES | CCOC(=O)C(C1=CC=CC=C1)O |
| Synonym | ethyl mandelate,ethyl phenylglycolate,mandelic acid, ethyl ester,dl-mandelic acid ethyl ester,mandelic acid ethyl ester,ethyl dl-mandelate,mandelsaeureaethylester,ethyl hydroxy phenyl acetate,mandelsaeureaethylester german,+-ethyl mandelate |
| IUPAC Name | ethyl 2-hydroxy-2-phenylacetate |
| InChI Key | SAXHIDRUJXPDOD-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
4-Hydroxycyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 17419-81-7 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00077974 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 | 17419-81-7 |
| Molecular Weight (g/mol) | 144.17 |
| MDL Number | MFCD00077974 |
| SMILES | C1CC(CCC1C(=O)O)O |
| IUPAC Name | 4-hydroxycyclohexane-1-carboxylic acid |
| InChI Key | HCFRWBBJISAZNK-UHFFFAOYSA-N |
| Molecular Formula | C7H12O3 |
(S)-(+)-1,3-Butanediol 98.0+%, TCI America™
CAS: 24621-61-2 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 MDL Number: MFCD00064278 InChI Key: PUPZLCDOIYMWBV-BYPYZUCNSA-N Synonym: s-+-1,3-butanediol,s-butane-1,3-diol,3s-butane-1,3-diol,s-1,3-butanediol,s-+-butane-1,3-diol,1,3-butanediol, 3s,bu2,1,3-butanediol, s,pubchem6722 PubChem CID: 446973 ChEBI: CHEBI:52688 IUPAC Name: (3S)-butane-1,3-diol SMILES: CC(CCO)O
| PubChem CID | 446973 |
|---|---|
| CAS | 24621-61-2 |
| Molecular Weight (g/mol) | 90.122 |
| ChEBI | CHEBI:52688 |
| MDL Number | MFCD00064278 |
| SMILES | CC(CCO)O |
| Synonym | s-+-1,3-butanediol,s-butane-1,3-diol,3s-butane-1,3-diol,s-1,3-butanediol,s-+-butane-1,3-diol,1,3-butanediol, 3s,bu2,1,3-butanediol, s,pubchem6722 |
| IUPAC Name | (3S)-butane-1,3-diol |
| InChI Key | PUPZLCDOIYMWBV-BYPYZUCNSA-N |
| Molecular Formula | C4H10O2 |
1-Phenylethane-1,2-diol 98.0+%, TCI America™
CAS: 93-56-1 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00003546 InChI Key: PWMWNFMRSKOCEY-UHFFFAOYSA-N Synonym: 1-phenyl-1,2-ethanediol,styrene glycol,phenylethylene glycol,phenylethanediol,phenyl glycol,1,2-ethanediol, 1-phenyl,phenyl-1,2-ethanediol,styrolyl alcohol,fenylglycol,1-phenylethylene glycol PubChem CID: 7149 IUPAC Name: 1-phenylethane-1,2-diol SMILES: C1=CC=C(C=C1)C(CO)O
| PubChem CID | 7149 |
|---|---|
| CAS | 93-56-1 |
| Molecular Weight (g/mol) | 138.166 |
| MDL Number | MFCD00003546 |
| SMILES | C1=CC=C(C=C1)C(CO)O |
| Synonym | 1-phenyl-1,2-ethanediol,styrene glycol,phenylethylene glycol,phenylethanediol,phenyl glycol,1,2-ethanediol, 1-phenyl,phenyl-1,2-ethanediol,styrolyl alcohol,fenylglycol,1-phenylethylene glycol |
| IUPAC Name | 1-phenylethane-1,2-diol |
| InChI Key | PWMWNFMRSKOCEY-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
3,3-Dimethyl-1-butanol 95.0+%, TCI America™
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 |
Octaethylene Glycol 96.0+%, TCI America™
CAS: 5117-19-1 Molecular Formula: C16H34O9 Molecular Weight (g/mol): 370.439 MDL Number: MFCD00698694 InChI Key: GLZWNFNQMJAZGY-UHFFFAOYSA-N PubChem CID: 78798 ChEBI: CHEBI:44794 IUPAC Name: 2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol SMILES: C(COCCOCCOCCOCCOCCOCCOCCO)O
| PubChem CID | 78798 |
|---|---|
| CAS | 5117-19-1 |
| Molecular Weight (g/mol) | 370.439 |
| ChEBI | CHEBI:44794 |
| MDL Number | MFCD00698694 |
| SMILES | C(COCCOCCOCCOCCOCCOCCOCCO)O |
| IUPAC Name | 2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | GLZWNFNQMJAZGY-UHFFFAOYSA-N |
| Molecular Formula | C16H34O9 |
3,3,5-Trimethylcyclohexyl Mandelate (mixture of isomers) 94.0+%, TCI America™
CAS: 456-59-7 Molecular Formula: C17H24O3 Molecular Weight (g/mol): 276.38 MDL Number: MFCD00056623 InChI Key: WZHCOOQXZCIUNC-UHFFFAOYNA-N Synonym: Cyclandelate, Mandelic Acid 3,3,5-Trimethylcyclohexyl Ester PubChem CID: 2893 ChEBI: CHEBI:3988 IUPAC Name: 3,3,5-trimethylcyclohexyl 2-hydroxy-2-phenylacetate SMILES: CC1CC(CC(C)(C)C1)OC(=O)C(O)C1=CC=CC=C1
| PubChem CID | 2893 |
|---|---|
| CAS | 456-59-7 |
| Molecular Weight (g/mol) | 276.38 |
| ChEBI | CHEBI:3988 |
| MDL Number | MFCD00056623 |
| SMILES | CC1CC(CC(C)(C)C1)OC(=O)C(O)C1=CC=CC=C1 |
| Synonym | Cyclandelate, Mandelic Acid 3,3,5-Trimethylcyclohexyl Ester |
| IUPAC Name | 3,3,5-trimethylcyclohexyl 2-hydroxy-2-phenylacetate |
| InChI Key | WZHCOOQXZCIUNC-UHFFFAOYNA-N |
| Molecular Formula | C17H24O3 |
alpha-Cyclohexyl-DL-mandelic Acid 98.0+%, TCI America™
CAS: 4335-77-7 Molecular Formula: C14H18O3 Molecular Weight (g/mol): 234.295 MDL Number: MFCD00194543 InChI Key: YTRNSQPXEDGWMR-UHFFFAOYSA-N Synonym: alpha-cyclohexylmandelic acid,2-cyclohexylmandelic acid,cyclohexylphenylglycolic acid,lespedamine,hexahydrobenzilic acid,cyclohexylmandelic acid,cyclohexyl-hydroxy-phenyl-acetic acid,cyclohexyl hydroxy phenylacetic acid,phenyl-cyclohexylglycolic acid,rcc 32 PubChem CID: 97700 IUPAC Name: 2-cyclohexyl-2-hydroxy-2-phenylacetic acid SMILES: C1CCC(CC1)C(C2=CC=CC=C2)(C(=O)O)O
| PubChem CID | 97700 |
|---|---|
| CAS | 4335-77-7 |
| Molecular Weight (g/mol) | 234.295 |
| MDL Number | MFCD00194543 |
| SMILES | C1CCC(CC1)C(C2=CC=CC=C2)(C(=O)O)O |
| Synonym | alpha-cyclohexylmandelic acid,2-cyclohexylmandelic acid,cyclohexylphenylglycolic acid,lespedamine,hexahydrobenzilic acid,cyclohexylmandelic acid,cyclohexyl-hydroxy-phenyl-acetic acid,cyclohexyl hydroxy phenylacetic acid,phenyl-cyclohexylglycolic acid,rcc 32 |
| IUPAC Name | 2-cyclohexyl-2-hydroxy-2-phenylacetic acid |
| InChI Key | YTRNSQPXEDGWMR-UHFFFAOYSA-N |
| Molecular Formula | C14H18O3 |
Jervine 97.0+%, TCI America™
CAS: 469-59-0 Molecular Formula: C27H39NO3 Molecular Weight (g/mol): 425.61 MDL Number: MFCD01684066 InChI Key: CLEXYFLHGFJONT-UHFFFAOYNA-N Synonym: jervine,iervin,jerwiny polish,11-ketocyclopamine,unii-19v3ecx465,veratraman-11-one, 17,23-epoxy-3-hydroxy-, 3beta,23beta,17,23beta-epoxy-3beta-hydroxyveratraman-11-one,spiro 9h-benzo a fluorene-9,2' 3'h-furo 3,2-b-pyridin-11 1h-one, 2,3,3'a,4,4',5',6,6',6a,6b,7,7',7'a,8,11a,11b-hexadecahydro-3-hydroxy-3',6',10, 11b-tetramethyl,jerwiny,veratraman-11-one, 17,23-epoxy-3-hydroxy-, 3-beta,23-beta PubChem CID: 10098 ChEBI: CHEBI:6088 IUPAC Name: 3-hydroxy-3',6',10,11b-tetramethyl-1,2,3,3'a,4,4',5',6,6',6a,6b,7,7',7'a,8,11,11a,11b-octadecahydro-3'H-spiro[cyclohexa[a]fluorene-9,2'-furo[3,2-b]pyridin]-11-one SMILES: CC1C2NCC(C)CC2OC11CCC2C3CC=C4CC(O)CCC4(C)C3C(=O)C2=C1C
| PubChem CID | 10098 |
|---|---|
| CAS | 469-59-0 |
| Molecular Weight (g/mol) | 425.61 |
| ChEBI | CHEBI:6088 |
| MDL Number | MFCD01684066 |
| SMILES | CC1C2NCC(C)CC2OC11CCC2C3CC=C4CC(O)CCC4(C)C3C(=O)C2=C1C |
| Synonym | jervine,iervin,jerwiny polish,11-ketocyclopamine,unii-19v3ecx465,veratraman-11-one, 17,23-epoxy-3-hydroxy-, 3beta,23beta,17,23beta-epoxy-3beta-hydroxyveratraman-11-one,spiro 9h-benzo a fluorene-9,2' 3'h-furo 3,2-b-pyridin-11 1h-one, 2,3,3'a,4,4',5',6,6',6a,6b,7,7',7'a,8,11a,11b-hexadecahydro-3-hydroxy-3',6',10, 11b-tetramethyl,jerwiny,veratraman-11-one, 17,23-epoxy-3-hydroxy-, 3-beta,23-beta |
| IUPAC Name | 3-hydroxy-3',6',10,11b-tetramethyl-1,2,3,3'a,4,4',5',6,6',6a,6b,7,7',7'a,8,11,11a,11b-octadecahydro-3'H-spiro[cyclohexa[a]fluorene-9,2'-furo[3,2-b]pyridin]-11-one |
| InChI Key | CLEXYFLHGFJONT-UHFFFAOYNA-N |
| Molecular Formula | C27H39NO3 |