Organooxygen compounds
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2-Chlorocyclohexanol 95.0+%, TCI America™
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CAS: 1561-86-0 Molecular Formula: C6H11ClO Molecular Weight (g/mol): 134.603 MDL Number: MFCD00003860 InChI Key: NYEWDMNOXFGGDX-UHFFFAOYSA-N Synonym: 2-chlorocyclohexanol,cyclohexanol, 2-chloro,cyclohexene chlorohydrin,2-chlor-cyclohexanol,acmc-209ddc,2-chloro-cyclohexan-1-ol,2-chlorocyclohexanol, technical grade PubChem CID: 15274 IUPAC Name: 2-chlorocyclohexan-1-ol SMILES: C1CCC(C(C1)O)Cl
| PubChem CID | 15274 |
|---|---|
| CAS | 1561-86-0 |
| Molecular Weight (g/mol) | 134.603 |
| MDL Number | MFCD00003860 |
| SMILES | C1CCC(C(C1)O)Cl |
| Synonym | 2-chlorocyclohexanol,cyclohexanol, 2-chloro,cyclohexene chlorohydrin,2-chlor-cyclohexanol,acmc-209ddc,2-chloro-cyclohexan-1-ol,2-chlorocyclohexanol, technical grade |
| IUPAC Name | 2-chlorocyclohexan-1-ol |
| InChI Key | NYEWDMNOXFGGDX-UHFFFAOYSA-N |
| Molecular Formula | C6H11ClO |
trans-4-Ethylcyclohexanol 96.0+%, TCI America™
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CAS: 19781-62-5 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.215 MDL Number: MFCD00070694 InChI Key: RVTKUJWGFBADIN-UHFFFAOYSA-N PubChem CID: 78293 IUPAC Name: 4-ethylcyclohexan-1-ol SMILES: CCC1CCC(CC1)O
| PubChem CID | 78293 |
|---|---|
| CAS | 19781-62-5 |
| Molecular Weight (g/mol) | 128.215 |
| MDL Number | MFCD00070694 |
| SMILES | CCC1CCC(CC1)O |
| IUPAC Name | 4-ethylcyclohexan-1-ol |
| InChI Key | RVTKUJWGFBADIN-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
2-Chloromethyl-1,3-dioxolane 95.0+%, TCI America™
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CAS: 2568-30-1 Molecular Formula: C4H7ClO2 Molecular Weight (g/mol): 122.548 MDL Number: MFCD00043402 InChI Key: IKZOMJGRWIOEDP-UHFFFAOYSA-N PubChem CID: 75727 IUPAC Name: 2-(chloromethyl)-1,3-dioxolane SMILES: C1COC(O1)CCl
| PubChem CID | 75727 |
|---|---|
| CAS | 2568-30-1 |
| Molecular Weight (g/mol) | 122.548 |
| MDL Number | MFCD00043402 |
| SMILES | C1COC(O1)CCl |
| IUPAC Name | 2-(chloromethyl)-1,3-dioxolane |
| InChI Key | IKZOMJGRWIOEDP-UHFFFAOYSA-N |
| Molecular Formula | C4H7ClO2 |
Butyl Dichloromethyl Ether 98.0+%, TCI America™
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CAS: 5312-73-2 Molecular Formula: C5H10Cl2O Molecular Weight (g/mol): 157.03 MDL Number: MFCD00191420 InChI Key: GVVHBNABFJZWIC-UHFFFAOYSA-N Synonym: Dichloromethyl Butyl Ether PubChem CID: 4278354 IUPAC Name: 1-(dichloromethoxy)butane SMILES: CCCCOC(Cl)Cl
| PubChem CID | 4278354 |
|---|---|
| CAS | 5312-73-2 |
| Molecular Weight (g/mol) | 157.03 |
| MDL Number | MFCD00191420 |
| SMILES | CCCCOC(Cl)Cl |
| Synonym | Dichloromethyl Butyl Ether |
| IUPAC Name | 1-(dichloromethoxy)butane |
| InChI Key | GVVHBNABFJZWIC-UHFFFAOYSA-N |
| Molecular Formula | C5H10Cl2O |
Methyl Trifluoropyruvate 98.0+%, TCI America™
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CAS: 13089-11-7 Molecular Formula: C4H3F3O3 Molecular Weight (g/mol): 156.06 MDL Number: MFCD00114936 InChI Key: XGLLQDIWQRQROJ-UHFFFAOYSA-N Synonym: methyl trifluoropyruvate,methyl 3,3,3-trifluoropyruvate,methyltrifluoropyruvate,trifluoropyruvic acid methyl ester,3,3,3-trifluoropyruvic acid methyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, methyl ester,pubchem2012,rarechem al bf 1300,acmc-1bp0j PubChem CID: 2734931 IUPAC Name: methyl 3,3,3-trifluoro-2-oxopropanoate SMILES: COC(=O)C(=O)C(F)(F)F
| PubChem CID | 2734931 |
|---|---|
| CAS | 13089-11-7 |
| Molecular Weight (g/mol) | 156.06 |
| MDL Number | MFCD00114936 |
| SMILES | COC(=O)C(=O)C(F)(F)F |
| Synonym | methyl trifluoropyruvate,methyl 3,3,3-trifluoropyruvate,methyltrifluoropyruvate,trifluoropyruvic acid methyl ester,3,3,3-trifluoropyruvic acid methyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, methyl ester,pubchem2012,rarechem al bf 1300,acmc-1bp0j |
| IUPAC Name | methyl 3,3,3-trifluoro-2-oxopropanoate |
| InChI Key | XGLLQDIWQRQROJ-UHFFFAOYSA-N |
| Molecular Formula | C4H3F3O3 |
2-Methyl-4'-(methylthio)-2-morpholinopropiophenone 98.0+%, TCI America™
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CAS: 71868-10-5 Molecular Formula: C15H21NO2S Molecular Weight (g/mol): 279.398 MDL Number: MFCD00083014 InChI Key: LWRBVKNFOYUCNP-UHFFFAOYSA-N Synonym: 2-Methyl-1-[4-(methylthio)phenyl]-2-morpholino-1-propanone PubChem CID: 92387 IUPAC Name: 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one SMILES: CC(C)(C(=O)C1=CC=C(C=C1)SC)N2CCOCC2
| PubChem CID | 92387 |
|---|---|
| CAS | 71868-10-5 |
| Molecular Weight (g/mol) | 279.398 |
| MDL Number | MFCD00083014 |
| SMILES | CC(C)(C(=O)C1=CC=C(C=C1)SC)N2CCOCC2 |
| Synonym | 2-Methyl-1-[4-(methylthio)phenyl]-2-morpholino-1-propanone |
| IUPAC Name | 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one |
| InChI Key | LWRBVKNFOYUCNP-UHFFFAOYSA-N |
| Molecular Formula | C15H21NO2S |
(S)-1,2-Butanediol 98.0+%, TCI America™
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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 |
Ethyl Malonyl Chloride 97.0+%, TCI America™
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CAS: 36239-09-5 Molecular Formula: C5H7ClO3 Molecular Weight (g/mol): 150.56 MDL Number: MFCD00000736 InChI Key: KWFADUNOPOSMIJ-UHFFFAOYSA-N Synonym: ethyl 3-chloro-3-oxopropionate,ethyl chloroformylacetate,ethyl chloroformyl acetate,propanoic acid, 3-chloro-3-oxo-, ethyl ester,ethyl3-chloro-3-oxopropanoate,ethyl malonylchloride,carbethoxyacetyl chloride,2-ethoxycarbonylacetyl chloride,ethyl 2-chlorocarbonyl acetate,chloroformyl acetic acid ethyl ester PubChem CID: 118931 IUPAC Name: ethyl 3-chloro-3-oxopropanoate SMILES: CCOC(=O)CC(Cl)=O
| PubChem CID | 118931 |
|---|---|
| CAS | 36239-09-5 |
| Molecular Weight (g/mol) | 150.56 |
| MDL Number | MFCD00000736 |
| SMILES | CCOC(=O)CC(Cl)=O |
| Synonym | ethyl 3-chloro-3-oxopropionate,ethyl chloroformylacetate,ethyl chloroformyl acetate,propanoic acid, 3-chloro-3-oxo-, ethyl ester,ethyl3-chloro-3-oxopropanoate,ethyl malonylchloride,carbethoxyacetyl chloride,2-ethoxycarbonylacetyl chloride,ethyl 2-chlorocarbonyl acetate,chloroformyl acetic acid ethyl ester |
| IUPAC Name | ethyl 3-chloro-3-oxopropanoate |
| InChI Key | KWFADUNOPOSMIJ-UHFFFAOYSA-N |
| Molecular Formula | C5H7ClO3 |
3,5-Diiodosalicylaldehyde 98.0+%, TCI America™
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CAS: 2631-77-8 Molecular Formula: C7H4I2O2 Molecular Weight (g/mol): 373.916 MDL Number: MFCD00003321 InChI Key: MYWSBJKVOUZCIA-UHFFFAOYSA-N Synonym: 3,5-diiodosalicylaldehyde,benzaldehyde, 2-hydroxy-3,5-diiodo,3,5-diiodo-2-hydroxybenzaldehyde,2-hydroxy-3,5-diiodo-benzaldehyde,acmc-20ancp,3,5-diodosolicylaldehyde,2,4-diiodo-6-formylphenol,#,benzaldehyde,2-hydroxy-3,5-diiodo PubChem CID: 75829 IUPAC Name: 2-hydroxy-3,5-diiodobenzaldehyde SMILES: C1=C(C=C(C(=C1I)O)C=O)I
| PubChem CID | 75829 |
|---|---|
| CAS | 2631-77-8 |
| Molecular Weight (g/mol) | 373.916 |
| MDL Number | MFCD00003321 |
| SMILES | C1=C(C=C(C(=C1I)O)C=O)I |
| Synonym | 3,5-diiodosalicylaldehyde,benzaldehyde, 2-hydroxy-3,5-diiodo,3,5-diiodo-2-hydroxybenzaldehyde,2-hydroxy-3,5-diiodo-benzaldehyde,acmc-20ancp,3,5-diodosolicylaldehyde,2,4-diiodo-6-formylphenol,#,benzaldehyde,2-hydroxy-3,5-diiodo |
| IUPAC Name | 2-hydroxy-3,5-diiodobenzaldehyde |
| InChI Key | MYWSBJKVOUZCIA-UHFFFAOYSA-N |
| Molecular Formula | C7H4I2O2 |
1,1-Dimethoxy-3-butanone 90.0+%, TCI America™
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CAS: 5436-21-5 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.16 MDL Number: MFCD00008789 InChI Key: PJCCSZUMZMCWSX-UHFFFAOYSA-N Synonym: 4,4-dimethoxy-2-butanone,acetylacetaldehyde dimethyl acetal,2-butanone, 4,4-dimethoxy,1,1-dimethoxy-3-butanone,acetoacetaldehyde dimethyl acetal,3-oxobutyraldehyde dimethyl acetal,4,4-dimethoxybutanone,acetylacetaldehyddimethylacetal,3-ketobutyraldehyde dimethylacetal,formylacetone dimethyl acetal PubChem CID: 228548 IUPAC Name: 4,4-dimethoxybutan-2-one SMILES: COC(CC(C)=O)OC
| PubChem CID | 228548 |
|---|---|
| CAS | 5436-21-5 |
| Molecular Weight (g/mol) | 132.16 |
| MDL Number | MFCD00008789 |
| SMILES | COC(CC(C)=O)OC |
| Synonym | 4,4-dimethoxy-2-butanone,acetylacetaldehyde dimethyl acetal,2-butanone, 4,4-dimethoxy,1,1-dimethoxy-3-butanone,acetoacetaldehyde dimethyl acetal,3-oxobutyraldehyde dimethyl acetal,4,4-dimethoxybutanone,acetylacetaldehyddimethylacetal,3-ketobutyraldehyde dimethylacetal,formylacetone dimethyl acetal |
| IUPAC Name | 4,4-dimethoxybutan-2-one |
| InChI Key | PJCCSZUMZMCWSX-UHFFFAOYSA-N |
| Molecular Formula | C6H12O3 |
6-Hydroxy-3-coumaranone 97.0+%, TCI America™
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CAS: 6272-26-0 Molecular Formula: C8H6O3 Molecular Weight (g/mol): 150.13 MDL Number: MFCD00068174 InChI Key: GBDMODVZBPFQKI-UHFFFAOYSA-N Synonym: 6-hydroxybenzofuran-3 2h-one,6-hydroxy-2h-benzofuran-3-one,6-hydroxy-2,3-dihydrobenzo b furan-3-one,6-hydroxy-1-benzofuran-3 2h-one,6-hydroxybenzofuran-3-one,3 2h-benzofuranone, 6-hydroxy,6-hydroxy-3-coumaranone,6-hydroxy-2,3-dihydro-1-benzofuran-3-one,6-hydroxy-3 2h-benzofuranone,6-hydroxy-2h-1-benzofuran-3-one PubChem CID: 235717 IUPAC Name: 6-hydroxy-2,3-dihydro-1-benzofuran-3-one SMILES: OC1=CC=C2C(=O)COC2=C1
| PubChem CID | 235717 |
|---|---|
| CAS | 6272-26-0 |
| Molecular Weight (g/mol) | 150.13 |
| MDL Number | MFCD00068174 |
| SMILES | OC1=CC=C2C(=O)COC2=C1 |
| Synonym | 6-hydroxybenzofuran-3 2h-one,6-hydroxy-2h-benzofuran-3-one,6-hydroxy-2,3-dihydrobenzo b furan-3-one,6-hydroxy-1-benzofuran-3 2h-one,6-hydroxybenzofuran-3-one,3 2h-benzofuranone, 6-hydroxy,6-hydroxy-3-coumaranone,6-hydroxy-2,3-dihydro-1-benzofuran-3-one,6-hydroxy-3 2h-benzofuranone,6-hydroxy-2h-1-benzofuran-3-one |
| IUPAC Name | 6-hydroxy-2,3-dihydro-1-benzofuran-3-one |
| InChI Key | GBDMODVZBPFQKI-UHFFFAOYSA-N |
| Molecular Formula | C8H6O3 |
(+)-5,6-O-Isopropylidene-L-ascorbic Acid 98.0+%, TCI America™
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CAS: 15042-01-0 Molecular Formula: C9H12O6 Molecular Weight (g/mol): 216.189 MDL Number: MFCD00010552 InChI Key: POXUQBFHDHCZAD-MHTLYPKNSA-N PubChem CID: 54691418 IUPAC Name: (2R)-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,4-dihydroxy-2H-furan-5-one SMILES: CC1(OCC(O1)C2C(=C(C(=O)O2)O)O)C
| PubChem CID | 54691418 |
|---|---|
| CAS | 15042-01-0 |
| Molecular Weight (g/mol) | 216.189 |
| MDL Number | MFCD00010552 |
| SMILES | CC1(OCC(O1)C2C(=C(C(=O)O2)O)O)C |
| IUPAC Name | (2R)-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,4-dihydroxy-2H-furan-5-one |
| InChI Key | POXUQBFHDHCZAD-MHTLYPKNSA-N |
| Molecular Formula | C9H12O6 |
Ethyl DL-Mandelate 95.0+%, TCI America™
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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 |
Isopropyl Acetoacetate 97.0+%, TCI America™
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CAS: 542-08-5 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00043933 InChI Key: GVIIRWAJDFKJMJ-UHFFFAOYSA-N Synonym: isopropyl acetoacetate,isopropyl 3-oxobutanoate,acetoacetic acid isopropyl ester,butanoic acid, 3-oxo-, 1-methylethyl ester,unii-38gtb2c6xc,38gtb2c6xc,methylethyl 3-oxobutanoate,acip,isopropyl acetylacetate,isopropyl 3-oxobutyrate PubChem CID: 68329 IUPAC Name: propan-2-yl 3-oxobutanoate SMILES: CC(C)OC(=O)CC(=O)C
| PubChem CID | 68329 |
|---|---|
| CAS | 542-08-5 |
| Molecular Weight (g/mol) | 144.17 |
| MDL Number | MFCD00043933 |
| SMILES | CC(C)OC(=O)CC(=O)C |
| Synonym | isopropyl acetoacetate,isopropyl 3-oxobutanoate,acetoacetic acid isopropyl ester,butanoic acid, 3-oxo-, 1-methylethyl ester,unii-38gtb2c6xc,38gtb2c6xc,methylethyl 3-oxobutanoate,acip,isopropyl acetylacetate,isopropyl 3-oxobutyrate |
| IUPAC Name | propan-2-yl 3-oxobutanoate |
| InChI Key | GVIIRWAJDFKJMJ-UHFFFAOYSA-N |
| Molecular Formula | C7H12O3 |
Triethyl Orthochloroacetate 95.0+%, TCI America™
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CAS: 51076-95-0 Molecular Formula: C8H17ClO3 Molecular Weight (g/mol): 196.671 MDL Number: MFCD00142889 InChI Key: URFKLQSFBXBOQU-UHFFFAOYSA-N Synonym: 2-chloro-1,1,1-triethoxy-ethane,triethyl orthochloroacetate,2-chloro-1,1,1-triethoxy ethane,orthochloroacetic acid triethyl ester,ethane, 2-chloro-1,1,1-triethoxy,chlorotriethoxyethane,acmc-209tex,2-chloro-1, 1,1-triethoxy-ethane,2-chloranyl-1,1,1-triethoxy-ethane,2-chloro-1,1,1-triethoxyethane PubChem CID: 305922 IUPAC Name: 2-chloro-1,1,1-triethoxyethane SMILES: CCOC(CCl)(OCC)OCC
| PubChem CID | 305922 |
|---|---|
| CAS | 51076-95-0 |
| Molecular Weight (g/mol) | 196.671 |
| MDL Number | MFCD00142889 |
| SMILES | CCOC(CCl)(OCC)OCC |
| Synonym | 2-chloro-1,1,1-triethoxy-ethane,triethyl orthochloroacetate,2-chloro-1,1,1-triethoxy ethane,orthochloroacetic acid triethyl ester,ethane, 2-chloro-1,1,1-triethoxy,chlorotriethoxyethane,acmc-209tex,2-chloro-1, 1,1-triethoxy-ethane,2-chloranyl-1,1,1-triethoxy-ethane,2-chloro-1,1,1-triethoxyethane |
| IUPAC Name | 2-chloro-1,1,1-triethoxyethane |
| InChI Key | URFKLQSFBXBOQU-UHFFFAOYSA-N |
| Molecular Formula | C8H17ClO3 |