
Organooxygen compounds
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2,2'-Dichlorobenzil, 98+%
CAS: 21854-95-5 Molecular Formula: C14H8Cl2O2 Molecular Weight (g/mol): 279.116 MDL Number: MFCD00018263 InChI Key: VOSNNSVWVJFJCR-UHFFFAOYSA-N Synonym: 2,2'-dichlorobenzil,1,2-bis 2-chlorophenyl ethane-1,2-dione,ethanedione, bis 2-chlorophenyl,2,2'-dichlorodibenzoyl,benzil, 2,2'-dichloro,1,2-ethanedione, 1,2-bis 2-chlorophenyl,bis 2-chlorophenyl ethane-1,2-dione,benzil,2'-dichloro,2,2/'-dichlorobenzil,acmc-20aok0 PubChem CID: 89076 IUPAC Name: 1,2-bis(2-chlorophenyl)ethane-1,2-dione SMILES: C1=CC=C(C(=C1)C(=O)C(=O)C2=CC=CC=C2Cl)Cl
PubChem CID | 89076 |
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CAS | 21854-95-5 |
Molecular Weight (g/mol) | 279.116 |
MDL Number | MFCD00018263 |
SMILES | C1=CC=C(C(=C1)C(=O)C(=O)C2=CC=CC=C2Cl)Cl |
Synonym | 2,2'-dichlorobenzil,1,2-bis 2-chlorophenyl ethane-1,2-dione,ethanedione, bis 2-chlorophenyl,2,2'-dichlorodibenzoyl,benzil, 2,2'-dichloro,1,2-ethanedione, 1,2-bis 2-chlorophenyl,bis 2-chlorophenyl ethane-1,2-dione,benzil,2'-dichloro,2,2/'-dichlorobenzil,acmc-20aok0 |
IUPAC Name | 1,2-bis(2-chlorophenyl)ethane-1,2-dione |
InChI Key | VOSNNSVWVJFJCR-UHFFFAOYSA-N |
Molecular Formula | C14H8Cl2O2 |
2-Chlorophenyl cyclopentyl ketone, 97%
CAS: 6740-85-8 Molecular Formula: C12H13ClO Molecular Weight (g/mol): 208.685 MDL Number: MFCD00038367 InChI Key: QIJMMRNZBJHXRI-UHFFFAOYSA-N Synonym: 2-chlorophenyl cyclopentyl ketone,2-chlorophenyl cyclopentyl methanone,o-chlorophenyl cyclopentyl ketone,o-chlorobenzoylcyclopentane,2-chlorophenyl-cyclopentylketone,methanone, 2-chlorophenyl cyclopentyl,2-chlorobenzoylcyclopentane,acmc-1b5a4,0-chlorphenylcyclopentylketone,1-2-chlorobenzoyl cyclopentane PubChem CID: 81223 IUPAC Name: (2-chlorophenyl)-cyclopentylmethanone SMILES: C1CCC(C1)C(=O)C2=CC=CC=C2Cl
PubChem CID | 81223 |
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CAS | 6740-85-8 |
Molecular Weight (g/mol) | 208.685 |
MDL Number | MFCD00038367 |
SMILES | C1CCC(C1)C(=O)C2=CC=CC=C2Cl |
Synonym | 2-chlorophenyl cyclopentyl ketone,2-chlorophenyl cyclopentyl methanone,o-chlorophenyl cyclopentyl ketone,o-chlorobenzoylcyclopentane,2-chlorophenyl-cyclopentylketone,methanone, 2-chlorophenyl cyclopentyl,2-chlorobenzoylcyclopentane,acmc-1b5a4,0-chlorphenylcyclopentylketone,1-2-chlorobenzoyl cyclopentane |
IUPAC Name | (2-chlorophenyl)-cyclopentylmethanone |
InChI Key | QIJMMRNZBJHXRI-UHFFFAOYSA-N |
Molecular Formula | C12H13ClO |
5-Ethyl-2-furaldehyde, 98%
CAS: 23074-10-4 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00030605 InChI Key: XADGZBXFWQHBDB-UHFFFAOYSA-N PubChem CID: 89989 IUPAC Name: 5-ethylfuran-2-carbaldehyde SMILES: CCC1=CC=C(O1)C=O
PubChem CID | 89989 |
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CAS | 23074-10-4 |
Molecular Weight (g/mol) | 124.14 |
MDL Number | MFCD00030605 |
SMILES | CCC1=CC=C(O1)C=O |
IUPAC Name | 5-ethylfuran-2-carbaldehyde |
InChI Key | XADGZBXFWQHBDB-UHFFFAOYSA-N |
Molecular Formula | C7H8O2 |
trans-1,2-Cyclohexanediol, 98%
CAS: 1460-57-7 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00063611 InChI Key: PFURGBBHAOXLIO-PHDIDXHHSA-N Synonym: trans-1,2-cyclohexanediol,trans-cyclohexane-1,2-diol,1r,2r-cyclohexane-1,2-diol,1r,2r-trans-1,2-cyclohexanediol,1,2-cyclohexanediol, 1r,2r-rel,trans-1,2-dihydroxycyclohexane,1,2-cyclohexanediol, trans,l6tj aq bq&&trans,trans-1,2-cyclohexandiol,1r,2r-1,2-cyclohexanediol PubChem CID: 92886 ChEBI: CHEBI:16931 IUPAC Name: (1R,2R)-cyclohexane-1,2-diol SMILES: O[C@@H]1CCCC[C@H]1O
PubChem CID | 92886 |
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CAS | 1460-57-7 |
Molecular Weight (g/mol) | 116.16 |
ChEBI | CHEBI:16931 |
MDL Number | MFCD00063611 |
SMILES | O[C@@H]1CCCC[C@H]1O |
Synonym | trans-1,2-cyclohexanediol,trans-cyclohexane-1,2-diol,1r,2r-cyclohexane-1,2-diol,1r,2r-trans-1,2-cyclohexanediol,1,2-cyclohexanediol, 1r,2r-rel,trans-1,2-dihydroxycyclohexane,1,2-cyclohexanediol, trans,l6tj aq bq&&trans,trans-1,2-cyclohexandiol,1r,2r-1,2-cyclohexanediol |
IUPAC Name | (1R,2R)-cyclohexane-1,2-diol |
InChI Key | PFURGBBHAOXLIO-PHDIDXHHSA-N |
Molecular Formula | C6H12O2 |
Glycolaldehyde dimethyl acetal, 98%, stab. with ca 0.1% sodium carbonate
CAS: 30934-97-5 Molecular Formula: C4H10O3 Molecular Weight (g/mol): 106.12 MDL Number: MFCD00051799 InChI Key: NYPNCQTUZYWFGG-UHFFFAOYSA-N Synonym: glycolaldehyde dimethyl acetal,ethanol, 2,2-dimethoxy,unii-u5use33y47,2,2-dimethoxy-ethanol,2,2-dimethoxy ethanol,glycolaldehydedimethylacetal,acmc-20aksv,2,2-dimethoxyethan-1-ol,hydroxyacetaldehyde dimethylacetal,2-hydroxyacetaldehyde dimethyl acetal PubChem CID: 542381 IUPAC Name: 2,2-dimethoxyethanol SMILES: COC(CO)OC
PubChem CID | 542381 |
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CAS | 30934-97-5 |
Molecular Weight (g/mol) | 106.12 |
MDL Number | MFCD00051799 |
SMILES | COC(CO)OC |
Synonym | glycolaldehyde dimethyl acetal,ethanol, 2,2-dimethoxy,unii-u5use33y47,2,2-dimethoxy-ethanol,2,2-dimethoxy ethanol,glycolaldehydedimethylacetal,acmc-20aksv,2,2-dimethoxyethan-1-ol,hydroxyacetaldehyde dimethylacetal,2-hydroxyacetaldehyde dimethyl acetal |
IUPAC Name | 2,2-dimethoxyethanol |
InChI Key | NYPNCQTUZYWFGG-UHFFFAOYSA-N |
Molecular Formula | C4H10O3 |
Chloroacetaldehyde diethyl acetal, 98%
CAS: 621-62-5 Molecular Formula: C6H13ClO2 Molecular Weight (g/mol): 152.62 MDL Number: MFCD00000949 InChI Key: OVXJWSYBABKZMD-UHFFFAOYSA-N Synonym: chloroacetaldehyde diethyl acetal,chloroacetal,ethane, 2-chloro-1,1-diethoxy,diethoxyethyl chloride,1,1-diethoxy-2-chloroethane,2-chloroacetaldehyde diethyl acetal,monochloroacetaldehyde diethyl acetal,chloroacetaldehydediethylacetal,acetaldehyde, chloro-, diethyl acetal,2-chloroacetal PubChem CID: 12128 IUPAC Name: 2-chloro-1,1-diethoxyethane SMILES: CCOC(CCl)OCC
PubChem CID | 12128 |
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CAS | 621-62-5 |
Molecular Weight (g/mol) | 152.62 |
MDL Number | MFCD00000949 |
SMILES | CCOC(CCl)OCC |
Synonym | chloroacetaldehyde diethyl acetal,chloroacetal,ethane, 2-chloro-1,1-diethoxy,diethoxyethyl chloride,1,1-diethoxy-2-chloroethane,2-chloroacetaldehyde diethyl acetal,monochloroacetaldehyde diethyl acetal,chloroacetaldehydediethylacetal,acetaldehyde, chloro-, diethyl acetal,2-chloroacetal |
IUPAC Name | 2-chloro-1,1-diethoxyethane |
InChI Key | OVXJWSYBABKZMD-UHFFFAOYSA-N |
Molecular Formula | C6H13ClO2 |
(S)-(+)-2-(6-Methoxy-2-naphthyl)propionic acid, 99%
CAS: 22204-53-1 Molecular Formula: C14H14O3 Molecular Weight (g/mol): 230.263 MDL Number: MFCD00010500 InChI Key: CMWTZPSULFXXJA-VIFPVBQESA-N Synonym: naproxen,s-naproxen,naprosyn,naproxene,+-naproxen,equiproxen,aleve,s-+-2-6-methoxy-2-naphthyl propionic acid,laraflex,naproxeno PubChem CID: 156391 ChEBI: CHEBI:7476 IUPAC Name: (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid SMILES: CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O
PubChem CID | 156391 |
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CAS | 22204-53-1 |
Molecular Weight (g/mol) | 230.263 |
ChEBI | CHEBI:7476 |
MDL Number | MFCD00010500 |
SMILES | CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O |
Synonym | naproxen,s-naproxen,naprosyn,naproxene,+-naproxen,equiproxen,aleve,s-+-2-6-methoxy-2-naphthyl propionic acid,laraflex,naproxeno |
IUPAC Name | (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid |
InChI Key | CMWTZPSULFXXJA-VIFPVBQESA-N |
Molecular Formula | C14H14O3 |
Bromomethyl methyl ether, tech. 90%
CAS: 13057-17-5 Molecular Formula: C2H5BrO Molecular Weight (g/mol): 124.965 MDL Number: MFCD00000171 InChI Key: JAMFGQBENKSWOF-UHFFFAOYSA-N Synonym: bromomethyl methyl ether,methane, bromomethoxy,bromo methoxy methane,methoxymethyl bromide,ether, bromomethyl methyl,bromomethylmethylether,methoxymethylbromide,mombr,bromo-methoxy-methane,bromomethyl methylether PubChem CID: 83093 IUPAC Name: bromo(methoxy)methane SMILES: COCBr
PubChem CID | 83093 |
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CAS | 13057-17-5 |
Molecular Weight (g/mol) | 124.965 |
MDL Number | MFCD00000171 |
SMILES | COCBr |
Synonym | bromomethyl methyl ether,methane, bromomethoxy,bromo methoxy methane,methoxymethyl bromide,ether, bromomethyl methyl,bromomethylmethylether,methoxymethylbromide,mombr,bromo-methoxy-methane,bromomethyl methylether |
IUPAC Name | bromo(methoxy)methane |
InChI Key | JAMFGQBENKSWOF-UHFFFAOYSA-N |
Molecular Formula | C2H5BrO |
4'-Fluoro-2'-methoxyacetophenone, 97%
CAS: 51788-80-8 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.167 MDL Number: MFCD00061143 InChI Key: YOXBPWVWNQROBJ-UHFFFAOYSA-N Synonym: 1-4-fluoro-2-methoxyphenyl ethanone,4-fluoro-2-methoxyacetophenone,4'-fluoro-2'-methoxyacetophenone,1-4-fluoro-2-methoxyphenyl ethan-1-one,2'-methoxy-4'-fluoroacetophenone,1-4-fluoro-2-methoxy-phenyl-ethanone,1-acetyl-4-fluoro-2-methoxybenzene,2-methoxy-4-fluoroacetophenone,4'-fluoro-2'-methoxyacetophenone,,pubchem13459 PubChem CID: 142887 IUPAC Name: 1-(4-fluoro-2-methoxyphenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)F)OC
PubChem CID | 142887 |
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CAS | 51788-80-8 |
Molecular Weight (g/mol) | 168.167 |
MDL Number | MFCD00061143 |
SMILES | CC(=O)C1=C(C=C(C=C1)F)OC |
Synonym | 1-4-fluoro-2-methoxyphenyl ethanone,4-fluoro-2-methoxyacetophenone,4'-fluoro-2'-methoxyacetophenone,1-4-fluoro-2-methoxyphenyl ethan-1-one,2'-methoxy-4'-fluoroacetophenone,1-4-fluoro-2-methoxy-phenyl-ethanone,1-acetyl-4-fluoro-2-methoxybenzene,2-methoxy-4-fluoroacetophenone,4'-fluoro-2'-methoxyacetophenone,,pubchem13459 |
IUPAC Name | 1-(4-fluoro-2-methoxyphenyl)ethanone |
InChI Key | YOXBPWVWNQROBJ-UHFFFAOYSA-N |
Molecular Formula | C9H9FO2 |
3',4'-Dimethoxyacetophenone, 98+%
CAS: 1131-62-0 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00008737 InChI Key: IQZLUWLMQNGTIW-UHFFFAOYSA-N Synonym: 3',4'-dimethoxyacetophenone,1-3,4-dimethoxyphenyl ethanone,3,4-dimethoxyacetophenone,acetoveratrone,ethanone, 1-3,4-dimethoxyphenyl,1-3,4-dimethoxyphenyl ethan-1-one,3,4-dimethoxyphenyl methyl ketone,unii-5rv6436s8a,acetophenone, 3',4'-dimethoxy,acetophenone,4'-dimethoxy PubChem CID: 14328 ChEBI: CHEBI:86576 IUPAC Name: 1-(3,4-dimethoxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)OC)OC
PubChem CID | 14328 |
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CAS | 1131-62-0 |
Molecular Weight (g/mol) | 180.203 |
ChEBI | CHEBI:86576 |
MDL Number | MFCD00008737 |
SMILES | CC(=O)C1=CC(=C(C=C1)OC)OC |
Synonym | 3',4'-dimethoxyacetophenone,1-3,4-dimethoxyphenyl ethanone,3,4-dimethoxyacetophenone,acetoveratrone,ethanone, 1-3,4-dimethoxyphenyl,1-3,4-dimethoxyphenyl ethan-1-one,3,4-dimethoxyphenyl methyl ketone,unii-5rv6436s8a,acetophenone, 3',4'-dimethoxy,acetophenone,4'-dimethoxy |
IUPAC Name | 1-(3,4-dimethoxyphenyl)ethanone |
InChI Key | IQZLUWLMQNGTIW-UHFFFAOYSA-N |
Molecular Formula | C10H12O3 |
(+/-)-2-Methyl-2,4-pentanediol, 98%
CAS: 107-41-5 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.176 MDL Number: MFCD00004547 InChI Key: SVTBMSDMJJWYQN-UHFFFAOYSA-N Synonym: hexylene glycol,2-methyl-2,4-pentanediol,pinakon,2,4-dihydroxy-2-methylpentane,2,4-pentanediol, 2-methyl,diolane,isol,4-methyl-2,4-pentanediol,1,1,3-trimethyltrimethylenediol,2-methyl pentane-2,4-diol PubChem CID: 7870 ChEBI: CHEBI:62995 IUPAC Name: 2-methylpentane-2,4-diol SMILES: CC(CC(C)(C)O)O
PubChem CID | 7870 |
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CAS | 107-41-5 |
Molecular Weight (g/mol) | 118.176 |
ChEBI | CHEBI:62995 |
MDL Number | MFCD00004547 |
SMILES | CC(CC(C)(C)O)O |
Synonym | hexylene glycol,2-methyl-2,4-pentanediol,pinakon,2,4-dihydroxy-2-methylpentane,2,4-pentanediol, 2-methyl,diolane,isol,4-methyl-2,4-pentanediol,1,1,3-trimethyltrimethylenediol,2-methyl pentane-2,4-diol |
IUPAC Name | 2-methylpentane-2,4-diol |
InChI Key | SVTBMSDMJJWYQN-UHFFFAOYSA-N |
Molecular Formula | C6H14O2 |
6-Ethoxy-2-mercaptobenzothiazole, 99%
CAS: 120-53-6 Molecular Formula: C9H9NOS2 Molecular Weight (g/mol): 211.297 MDL Number: MFCD00005782 InChI Key: HOASVNMVYBSLSU-UHFFFAOYSA-N Synonym: 6-ethoxy-2-mercaptobenzothiazole,6-ethoxybenzothiazole-2-thiol,2 3h-benzothiazolethione, 6-ethoxy,6-ethoxybenzothiazolethiol,usaf pd-58,6-ethoxy-2-benzothiazolethiol,6-ethoxybenzo d thiazole-2 3h-thione,6-ethoxy-1,3-benzothiazole-2-thiol,2-mercapto-6-ethoxybenzothiazole,2-benzothiazolethiol, 6-ethoxy PubChem CID: 719344 IUPAC Name: 6-ethoxy-3H-1,3-benzothiazole-2-thione SMILES: CCOC1=CC2=C(C=C1)NC(=S)S2
PubChem CID | 719344 |
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CAS | 120-53-6 |
Molecular Weight (g/mol) | 211.297 |
MDL Number | MFCD00005782 |
SMILES | CCOC1=CC2=C(C=C1)NC(=S)S2 |
Synonym | 6-ethoxy-2-mercaptobenzothiazole,6-ethoxybenzothiazole-2-thiol,2 3h-benzothiazolethione, 6-ethoxy,6-ethoxybenzothiazolethiol,usaf pd-58,6-ethoxy-2-benzothiazolethiol,6-ethoxybenzo d thiazole-2 3h-thione,6-ethoxy-1,3-benzothiazole-2-thiol,2-mercapto-6-ethoxybenzothiazole,2-benzothiazolethiol, 6-ethoxy |
IUPAC Name | 6-ethoxy-3H-1,3-benzothiazole-2-thione |
InChI Key | HOASVNMVYBSLSU-UHFFFAOYSA-N |
Molecular Formula | C9H9NOS2 |
1,2,4-Butanetriol, 96%, Thermo Scientific Chemicals
CAS: 3068-00-6 Molecular Formula: C4H10O3 Molecular Weight (g/mol): 106.121 MDL Number: MFCD00002929 InChI Key: ARXKVVRQIIOZGF-UHFFFAOYSA-N Synonym: 1,2,4-butanetriol,2-deoxyerythritol,1,3,4-butanetriol,triol 124,1,2,4-trihydroxybutane,1,2,4-butantriol,1,2,4-butantriol german,+/--1,2,4-butanetriol,2-deoxyerthritol,dialkylenethiourea PubChem CID: 18302 IUPAC Name: butane-1,2,4-triol SMILES: C(CO)C(CO)O
PubChem CID | 18302 |
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CAS | 3068-00-6 |
Molecular Weight (g/mol) | 106.121 |
MDL Number | MFCD00002929 |
SMILES | C(CO)C(CO)O |
Synonym | 1,2,4-butanetriol,2-deoxyerythritol,1,3,4-butanetriol,triol 124,1,2,4-trihydroxybutane,1,2,4-butantriol,1,2,4-butantriol german,+/--1,2,4-butanetriol,2-deoxyerthritol,dialkylenethiourea |
IUPAC Name | butane-1,2,4-triol |
InChI Key | ARXKVVRQIIOZGF-UHFFFAOYSA-N |
Molecular Formula | C4H10O3 |
Ethyl benzoylacetate, 90+%
CAS: 94-02-0 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00009196 InChI Key: GKKZMYDNDDMXSE-UHFFFAOYSA-N Synonym: ethyl benzoylacetate,benzoylacetic acid ethyl ester,ethyl benzoyl acetate,acetic acid, benzoyl-, ethyl ester,ethyl beta-oxobenzenepropanoate,ethylbenzoylacetate,benzoylacetic acid, ethyl ester,ethyl 3-phenyl-3-oxopropanoate,benzenepropanoic acid, beta-oxo-, ethyl ester,ethyl 3-oxo-3-phenylpropionate PubChem CID: 7170 IUPAC Name: ethyl 3-oxo-3-phenylpropanoate SMILES: CCOC(=O)CC(=O)C1=CC=CC=C1
PubChem CID | 7170 |
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CAS | 94-02-0 |
Molecular Weight (g/mol) | 192.214 |
MDL Number | MFCD00009196 |
SMILES | CCOC(=O)CC(=O)C1=CC=CC=C1 |
Synonym | ethyl benzoylacetate,benzoylacetic acid ethyl ester,ethyl benzoyl acetate,acetic acid, benzoyl-, ethyl ester,ethyl beta-oxobenzenepropanoate,ethylbenzoylacetate,benzoylacetic acid, ethyl ester,ethyl 3-phenyl-3-oxopropanoate,benzenepropanoic acid, beta-oxo-, ethyl ester,ethyl 3-oxo-3-phenylpropionate |
IUPAC Name | ethyl 3-oxo-3-phenylpropanoate |
InChI Key | GKKZMYDNDDMXSE-UHFFFAOYSA-N |
Molecular Formula | C11H12O3 |
2-(4-Methoxybenzoyl)thiophene, 97%
CAS: 4160-63-8 Molecular Formula: C12H10O2S Molecular Weight (g/mol): 218.27 MDL Number: MFCD00005440 InChI Key: KYVBFEMQEUXVQB-UHFFFAOYSA-N Synonym: 2-4-methoxybenzoyl thiophene,4-methoxyphenyl thiophen-2-yl methanone,2-p-methoxybenzoyl thiophene,p-anisyl thiophen-2-yl ketone,4-methoxyphenyl 2-thienyl ketone,methanone, 4-methoxyphenyl-2-thienyl,4-methoxyphenyl 2-thienyl methanone,pubchem10833,acmc-1aikh,2-thienyl p-anisyl ketone PubChem CID: 77812 IUPAC Name: (4-methoxyphenyl)-thiophen-2-ylmethanone SMILES: COC1=CC=C(C=C1)C(=O)C2=CC=CS2
PubChem CID | 77812 |
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CAS | 4160-63-8 |
Molecular Weight (g/mol) | 218.27 |
MDL Number | MFCD00005440 |
SMILES | COC1=CC=C(C=C1)C(=O)C2=CC=CS2 |
Synonym | 2-4-methoxybenzoyl thiophene,4-methoxyphenyl thiophen-2-yl methanone,2-p-methoxybenzoyl thiophene,p-anisyl thiophen-2-yl ketone,4-methoxyphenyl 2-thienyl ketone,methanone, 4-methoxyphenyl-2-thienyl,4-methoxyphenyl 2-thienyl methanone,pubchem10833,acmc-1aikh,2-thienyl p-anisyl ketone |
IUPAC Name | (4-methoxyphenyl)-thiophen-2-ylmethanone |
InChI Key | KYVBFEMQEUXVQB-UHFFFAOYSA-N |
Molecular Formula | C12H10O2S |