
Organooxygen compounds
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2-Chlorocyclohexanone, 97%, stab. with calcium carbonate/magnesium oxide
CAS: 822-87-7 Molecular Formula: C6H9ClO Molecular Weight (g/mol): 132.59 MDL Number: MFCD00001626 InChI Key: CCHNWURRBFGQCD-UHFFFAOYNA-N Synonym: 2-chlorocyclohexanone,cyclohexanone, 2-chloro,alpha-chlorocyclohexanone,2-chlorocyclohexonone,.alpha.-chlorocyclohexanone,2-chlorocyclohexanon,2-chlorocylohexanone,2-chloro cyclohexanone,2-chloro-cyclohexanone,acmc-209ted PubChem CID: 13203 IUPAC Name: 2-chlorocyclohexan-1-one SMILES: ClC1CCCCC1=O
PubChem CID | 13203 |
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CAS | 822-87-7 |
Molecular Weight (g/mol) | 132.59 |
MDL Number | MFCD00001626 |
SMILES | ClC1CCCCC1=O |
Synonym | 2-chlorocyclohexanone,cyclohexanone, 2-chloro,alpha-chlorocyclohexanone,2-chlorocyclohexonone,.alpha.-chlorocyclohexanone,2-chlorocyclohexanon,2-chlorocylohexanone,2-chloro cyclohexanone,2-chloro-cyclohexanone,acmc-209ted |
IUPAC Name | 2-chlorocyclohexan-1-one |
InChI Key | CCHNWURRBFGQCD-UHFFFAOYNA-N |
Molecular Formula | C6H9ClO |
Manganese(II) 2,4-pentanedionate
CAS: 14024-58-9 Molecular Formula: C10H14MnO4 Molecular Weight (g/mol): 253.16 MDL Number: MFCD00000022 MFCD09998212 InChI Key: ZQZQURFYFJBOCE-FDGPNNRMSA-L Synonym: bis 4-hydroxypent-3-en-2-one dihydrate manganese PubChem CID: 54669727 IUPAC Name: (Z)-4-hydroxypent-3-en-2-one;manganese;dihydrate SMILES: [Mn++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O
PubChem CID | 54669727 |
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CAS | 14024-58-9 |
Molecular Weight (g/mol) | 253.16 |
MDL Number | MFCD00000022 MFCD09998212 |
SMILES | [Mn++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O |
Synonym | bis 4-hydroxypent-3-en-2-one dihydrate manganese |
IUPAC Name | (Z)-4-hydroxypent-3-en-2-one;manganese;dihydrate |
InChI Key | ZQZQURFYFJBOCE-FDGPNNRMSA-L |
Molecular Formula | C10H14MnO4 |
3'-Fluoro-4'-methoxyacetophenone, 99%
CAS: 455-91-4 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.167 MDL Number: MFCD00026219 InChI Key: LQASUDVYVOFKNK-UHFFFAOYSA-N Synonym: 3'-fluoro-4'-methoxyacetophenone,3-fluoro-4-methoxyacetophenone,1-3-fluoro-4-methoxyphenyl ethanone,1-3-fluoro-4-methoxyphenyl ethan-1-one,ethanone, 1-3-fluoro-4-methoxyphenyl,3'-fluoro-4-methoxyacetophenone,acetophenone, 3'-fluoro-4'-methoxy,1-3-fluoro-4-methoxy-phenyl-ethanone,1-3-fluoro-4-methoxyphenyl-1-ethanone,1-3-fluoro-4-methoxy-phenyl ethanone PubChem CID: 96828 IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)OC)F
PubChem CID | 96828 |
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CAS | 455-91-4 |
Molecular Weight (g/mol) | 168.167 |
MDL Number | MFCD00026219 |
SMILES | CC(=O)C1=CC(=C(C=C1)OC)F |
Synonym | 3'-fluoro-4'-methoxyacetophenone,3-fluoro-4-methoxyacetophenone,1-3-fluoro-4-methoxyphenyl ethanone,1-3-fluoro-4-methoxyphenyl ethan-1-one,ethanone, 1-3-fluoro-4-methoxyphenyl,3'-fluoro-4-methoxyacetophenone,acetophenone, 3'-fluoro-4'-methoxy,1-3-fluoro-4-methoxy-phenyl-ethanone,1-3-fluoro-4-methoxyphenyl-1-ethanone,1-3-fluoro-4-methoxy-phenyl ethanone |
IUPAC Name | 1-(3-fluoro-4-methoxyphenyl)ethanone |
InChI Key | LQASUDVYVOFKNK-UHFFFAOYSA-N |
Molecular Formula | C9H9FO2 |
1,5-Dichloroanthraquinone, 96%
CAS: 82-46-2 Molecular Formula: C14H6Cl2O2 Molecular Weight (g/mol): 277.1 MDL Number: MFCD00001190 InChI Key: MQIUMARJCOGCIM-UHFFFAOYSA-N Synonym: 1,5-dichloroanthraquinone,9,10-anthracenedione, 1,5-dichloro,1,5-dichloro-9,10-anthraquinone,1,5-dichloranthrachinon,unii-s335v6mf9e,anthraquinone, 1,5-dichloro,1,5-dichloranthrachinon czech,1, 5-dichloroanthraquinone,1,5-dichloroanthra-9,10-quinone,1,5 dichloro aq PubChem CID: 6711 IUPAC Name: 1,5-dichloroanthracene-9,10-dione SMILES: C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C2=O)C(=CC=C3)Cl
PubChem CID | 6711 |
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CAS | 82-46-2 |
Molecular Weight (g/mol) | 277.1 |
MDL Number | MFCD00001190 |
SMILES | C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C2=O)C(=CC=C3)Cl |
Synonym | 1,5-dichloroanthraquinone,9,10-anthracenedione, 1,5-dichloro,1,5-dichloro-9,10-anthraquinone,1,5-dichloranthrachinon,unii-s335v6mf9e,anthraquinone, 1,5-dichloro,1,5-dichloranthrachinon czech,1, 5-dichloroanthraquinone,1,5-dichloroanthra-9,10-quinone,1,5 dichloro aq |
IUPAC Name | 1,5-dichloroanthracene-9,10-dione |
InChI Key | MQIUMARJCOGCIM-UHFFFAOYSA-N |
Molecular Formula | C14H6Cl2O2 |
2-Methylbutyraldehyde, 95%
CAS: 96-17-3 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00006984 InChI Key: BYGQBDHUGHBGMD-UHFFFAOYNA-N Synonym: 2-methylbutyraldehyde,butanal, 2-methyl,2-formylbutane,2-methylbutyric aldehyde,methylethylacetaldehyde,2-ethylpropanal,2-methyl-1-butanal,butyraldehyde, 2-methyl,acetaldehyde, ethylmethyl,alpha-methylbutanal PubChem CID: 7284 ChEBI: CHEBI:16182 IUPAC Name: 2-methylbutanal SMILES: CCC(C)C=O
PubChem CID | 7284 |
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CAS | 96-17-3 |
Molecular Weight (g/mol) | 86.13 |
ChEBI | CHEBI:16182 |
MDL Number | MFCD00006984 |
SMILES | CCC(C)C=O |
Synonym | 2-methylbutyraldehyde,butanal, 2-methyl,2-formylbutane,2-methylbutyric aldehyde,methylethylacetaldehyde,2-ethylpropanal,2-methyl-1-butanal,butyraldehyde, 2-methyl,acetaldehyde, ethylmethyl,alpha-methylbutanal |
IUPAC Name | 2-methylbutanal |
InChI Key | BYGQBDHUGHBGMD-UHFFFAOYNA-N |
Molecular Formula | C5H10O |
Ethyl 4,4-dimethyl-3-oxovalerate, 97%
CAS: 17094-34-7 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.22 MDL Number: MFCD00042886 InChI Key: VUYNTIDSHCJIKF-UHFFFAOYSA-N Synonym: ethyl pivaloylacetate,ethyl 4,4,4-trimethylacetoacetate,ethyl 4,4-dimethyl-3-oxovalerate,4,4-dimethyl-3-oxovaleric acid ethyl ester,pivaloylacetic acid ethyl ester,ethyl 4,4-dimethyl-3-oxo-pentanoate,pentanoic acid, 4,4-dimethyl-3-oxo-, ethyl ester,4,4-dimethyl-3-oxo-pentanoic acid ethyl ester,ethylpivaloylacetate,pubchem19816 PubChem CID: 86950 IUPAC Name: ethyl 4,4-dimethyl-3-oxopentanoate SMILES: CCOC(=O)CC(=O)C(C)(C)C
PubChem CID | 86950 |
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CAS | 17094-34-7 |
Molecular Weight (g/mol) | 172.22 |
MDL Number | MFCD00042886 |
SMILES | CCOC(=O)CC(=O)C(C)(C)C |
Synonym | ethyl pivaloylacetate,ethyl 4,4,4-trimethylacetoacetate,ethyl 4,4-dimethyl-3-oxovalerate,4,4-dimethyl-3-oxovaleric acid ethyl ester,pivaloylacetic acid ethyl ester,ethyl 4,4-dimethyl-3-oxo-pentanoate,pentanoic acid, 4,4-dimethyl-3-oxo-, ethyl ester,4,4-dimethyl-3-oxo-pentanoic acid ethyl ester,ethylpivaloylacetate,pubchem19816 |
IUPAC Name | ethyl 4,4-dimethyl-3-oxopentanoate |
InChI Key | VUYNTIDSHCJIKF-UHFFFAOYSA-N |
Molecular Formula | C9H16O3 |
Ethyl 2-chloroacetoacetate, 96%
CAS: 609-15-4 Molecular Formula: C6H9ClO3 Molecular Weight (g/mol): 164.59 MDL Number: MFCD00009141 InChI Key: RDULEYWUGKOCMR-UHFFFAOYNA-N PubChem CID: 11858 IUPAC Name: ethyl 2-chloro-3-oxobutanoate SMILES: CCOC(=O)C(Cl)C(C)=O
PubChem CID | 11858 |
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CAS | 609-15-4 |
Molecular Weight (g/mol) | 164.59 |
MDL Number | MFCD00009141 |
SMILES | CCOC(=O)C(Cl)C(C)=O |
IUPAC Name | ethyl 2-chloro-3-oxobutanoate |
InChI Key | RDULEYWUGKOCMR-UHFFFAOYNA-N |
Molecular Formula | C6H9ClO3 |
2,4,6-Trihydroxybenzaldehyde, 95%
CAS: 487-70-7 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.12 MDL Number: MFCD00003329 InChI Key: BTQAJGSMXCDDAJ-UHFFFAOYSA-N Synonym: phloroglucinaldehyde,benzaldehyde, 2,4,6-trihydroxy,formylphloroglucinal,phloroglucinolcarboxaldehyde,formylphloroglucinol,phloroglucinol aldehyde,2,4,6-trihydroxy-benzaldehyde,2,4,6-trihydroxybenzaldehyd,pubchem21790,acmc-1ao01 PubChem CID: 68099 IUPAC Name: 2,4,6-trihydroxybenzaldehyde SMILES: OC1=CC(O)=C(C=O)C(O)=C1
PubChem CID | 68099 |
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CAS | 487-70-7 |
Molecular Weight (g/mol) | 154.12 |
MDL Number | MFCD00003329 |
SMILES | OC1=CC(O)=C(C=O)C(O)=C1 |
Synonym | phloroglucinaldehyde,benzaldehyde, 2,4,6-trihydroxy,formylphloroglucinal,phloroglucinolcarboxaldehyde,formylphloroglucinol,phloroglucinol aldehyde,2,4,6-trihydroxy-benzaldehyde,2,4,6-trihydroxybenzaldehyd,pubchem21790,acmc-1ao01 |
IUPAC Name | 2,4,6-trihydroxybenzaldehyde |
InChI Key | BTQAJGSMXCDDAJ-UHFFFAOYSA-N |
Molecular Formula | C7H6O4 |
2'-Fluoro-4'-hydroxyacetophenone, 97%
CAS: 98619-07-9 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00142713 InChI Key: ZCZIRBNZMFUCOH-UHFFFAOYSA-N Synonym: 2'-fluoro-4'-hydroxyacetophenone,1-2-fluoro-4-hydroxyphenyl ethanone,4-hydroxy-2-fluoroacetophenone,2-fluoro-4-hydroxyacetophenone,1-2-fluoro-4-hydroxyphenyl-1-ethanone,1-2-fluoro-4-hydroxyphenyl ethan-1-one,1-2-fluoro-4-hydroxy-phenyl ethanone,ethanone, 1-2-fluoro-4-hydroxyphenyl,4'-hydroxy-2'-fluoroacetophenone PubChem CID: 2724912 IUPAC Name: 1-(2-fluoro-4-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC=C(O)C=C1F
PubChem CID | 2724912 |
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CAS | 98619-07-9 |
Molecular Weight (g/mol) | 154.14 |
MDL Number | MFCD00142713 |
SMILES | CC(=O)C1=CC=C(O)C=C1F |
Synonym | 2'-fluoro-4'-hydroxyacetophenone,1-2-fluoro-4-hydroxyphenyl ethanone,4-hydroxy-2-fluoroacetophenone,2-fluoro-4-hydroxyacetophenone,1-2-fluoro-4-hydroxyphenyl-1-ethanone,1-2-fluoro-4-hydroxyphenyl ethan-1-one,1-2-fluoro-4-hydroxy-phenyl ethanone,ethanone, 1-2-fluoro-4-hydroxyphenyl,4'-hydroxy-2'-fluoroacetophenone |
IUPAC Name | 1-(2-fluoro-4-hydroxyphenyl)ethanone |
InChI Key | ZCZIRBNZMFUCOH-UHFFFAOYSA-N |
Molecular Formula | C8H7FO2 |
3,4-Dimethyl-1-pentyn-3-ol, 94%
CAS: 1482-15-1 Molecular Formula: C7H12O Molecular Weight (g/mol): 112.17 MDL Number: MFCD00039845 InChI Key: DZNLEQBXXLGELU-UHFFFAOYNA-N PubChem CID: 95483 IUPAC Name: 3,4-dimethylpent-1-yn-3-ol SMILES: CC(C)C(C)(O)C#C
PubChem CID | 95483 |
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CAS | 1482-15-1 |
Molecular Weight (g/mol) | 112.17 |
MDL Number | MFCD00039845 |
SMILES | CC(C)C(C)(O)C#C |
IUPAC Name | 3,4-dimethylpent-1-yn-3-ol |
InChI Key | DZNLEQBXXLGELU-UHFFFAOYNA-N |
Molecular Formula | C7H12O |
4'-Isobutylacetophenone, 97%
CAS: 38861-78-8 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.259 MDL Number: MFCD00027393 InChI Key: KEAGRYYGYWZVPC-UHFFFAOYSA-N Synonym: 4'-isobutylacetophenone,4-isobutylacetophenone,p-iso-butylacetophenone,1-4-isobutylphenyl ethanone,p-isobutylacetophenone,ethanone, 1-4-2-methylpropyl phenyl,1-4-2-methylpropyl phenyl ethan-1-one,acetophenone, 4-isobutyl,1-4-2-methylpropyl phenyl ethanone,unii-aml715rd20 PubChem CID: 93214 IUPAC Name: 1-[4-(2-methylpropyl)phenyl]ethanone SMILES: CC(C)CC1=CC=C(C=C1)C(=O)C
PubChem CID | 93214 |
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CAS | 38861-78-8 |
Molecular Weight (g/mol) | 176.259 |
MDL Number | MFCD00027393 |
SMILES | CC(C)CC1=CC=C(C=C1)C(=O)C |
Synonym | 4'-isobutylacetophenone,4-isobutylacetophenone,p-iso-butylacetophenone,1-4-isobutylphenyl ethanone,p-isobutylacetophenone,ethanone, 1-4-2-methylpropyl phenyl,1-4-2-methylpropyl phenyl ethan-1-one,acetophenone, 4-isobutyl,1-4-2-methylpropyl phenyl ethanone,unii-aml715rd20 |
IUPAC Name | 1-[4-(2-methylpropyl)phenyl]ethanone |
InChI Key | KEAGRYYGYWZVPC-UHFFFAOYSA-N |
Molecular Formula | C12H16O |
Phenylglyoxal monohydrate, 97%
CAS: 1075-06-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00149499 InChI Key: NBIBDIKAOBCFJN-UHFFFAOYSA-N Synonym: dihydroxyacetophenone,acetophenone, dihydroxy,dihydroxy 1-phenylethanone,2,2-dihydroxy-1-phenyl-ethanone,ethanone, 2,2-dihydroxy-1-phenyl,acetophenone, 2,2-dihydroxy,alpha,alpha-dihydroxyacetophenone,dioxyacetophenone,alpha,alpha-dihydroxy-acetophenone PubChem CID: 99611 IUPAC Name: 2,2-dihydroxy-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)C(O)O
PubChem CID | 99611 |
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CAS | 1075-06-5 |
Molecular Weight (g/mol) | 152.149 |
MDL Number | MFCD00149499 |
SMILES | C1=CC=C(C=C1)C(=O)C(O)O |
Synonym | dihydroxyacetophenone,acetophenone, dihydroxy,dihydroxy 1-phenylethanone,2,2-dihydroxy-1-phenyl-ethanone,ethanone, 2,2-dihydroxy-1-phenyl,acetophenone, 2,2-dihydroxy,alpha,alpha-dihydroxyacetophenone,dioxyacetophenone,alpha,alpha-dihydroxy-acetophenone |
IUPAC Name | 2,2-dihydroxy-1-phenylethanone |
InChI Key | NBIBDIKAOBCFJN-UHFFFAOYSA-N |
Molecular Formula | C8H8O3 |
4-(Trifluoromethoxy)benzaldehyde, 96%
CAS: 659-28-9 Molecular Formula: C8H5F3O2 Molecular Weight (g/mol): 190.121 MDL Number: MFCD00041530 InChI Key: XQNVDQZWOBPLQZ-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy benzaldehyde,p-trifluoromethoxybenzaldehyde,p-trifluoromethoxy benzaldehyde,benzaldehyde, 4-trifluoromethoxy,4-trifluoromethoxy-benzaldehyde,alpha,alpha,alpha-trifluoroanisaldehyde,pubchem1471,acmc-209nsx PubChem CID: 69573 IUPAC Name: 4-(trifluoromethoxy)benzaldehyde SMILES: C1=CC(=CC=C1C=O)OC(F)(F)F
PubChem CID | 69573 |
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CAS | 659-28-9 |
Molecular Weight (g/mol) | 190.121 |
MDL Number | MFCD00041530 |
SMILES | C1=CC(=CC=C1C=O)OC(F)(F)F |
Synonym | 4-trifluoromethoxy benzaldehyde,p-trifluoromethoxybenzaldehyde,p-trifluoromethoxy benzaldehyde,benzaldehyde, 4-trifluoromethoxy,4-trifluoromethoxy-benzaldehyde,alpha,alpha,alpha-trifluoroanisaldehyde,pubchem1471,acmc-209nsx |
IUPAC Name | 4-(trifluoromethoxy)benzaldehyde |
InChI Key | XQNVDQZWOBPLQZ-UHFFFAOYSA-N |
Molecular Formula | C8H5F3O2 |
2-Bromopropiophenone, 96%
CAS: 2114-00-3 Molecular Formula: C9H9BrO Molecular Weight (g/mol): 213.074 MDL Number: MFCD00000145 InChI Key: WPDWOCRJBPXJFM-UHFFFAOYSA-N Synonym: 2-bromopropiophenone,1-propanone, 2-bromo-1-phenyl,alpha-bromopropiophenone,1-benzoyl-1-bromoethane,1-bromoethyl phenyl ketone,2-bromo-1-phenyl-1-propanone,propiophenone, 2-bromo,.alpha.-bromopropiophenone,2-bromo-1-phenyl-propan-1-one,2-bromo-propiophenone PubChem CID: 16452 IUPAC Name: 2-bromo-1-phenylpropan-1-one SMILES: CC(C(=O)C1=CC=CC=C1)Br
PubChem CID | 16452 |
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CAS | 2114-00-3 |
Molecular Weight (g/mol) | 213.074 |
MDL Number | MFCD00000145 |
SMILES | CC(C(=O)C1=CC=CC=C1)Br |
Synonym | 2-bromopropiophenone,1-propanone, 2-bromo-1-phenyl,alpha-bromopropiophenone,1-benzoyl-1-bromoethane,1-bromoethyl phenyl ketone,2-bromo-1-phenyl-1-propanone,propiophenone, 2-bromo,.alpha.-bromopropiophenone,2-bromo-1-phenyl-propan-1-one,2-bromo-propiophenone |
IUPAC Name | 2-bromo-1-phenylpropan-1-one |
InChI Key | WPDWOCRJBPXJFM-UHFFFAOYSA-N |
Molecular Formula | C9H9BrO |
2-Bromo-3'-methoxyacetophenone, 98%
CAS: 5000-65-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00000199 InChI Key: IOOHBIFQNQQUFI-UHFFFAOYSA-N Synonym: 2-bromo-1-3-methoxyphenyl ethanone,2-bromo-3'-methoxyacetophenone,m-methoxyphenacyl bromide,3'-methoxyphenacyl bromide,3-bromoacetyl anisole,2-bromo-1-3-methoxyphenyl ethan-1-one,3-methoxyphenacyl bromide,bromomethyl 3-methoxyphenyl ketone,ccris 7998,3-methoxyphenacylbromide PubChem CID: 101294 IUPAC Name: 2-bromo-1-(3-methoxyphenyl)ethanone SMILES: COC1=CC=CC(=C1)C(=O)CBr
PubChem CID | 101294 |
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CAS | 5000-65-7 |
Molecular Weight (g/mol) | 229.073 |
MDL Number | MFCD00000199 |
SMILES | COC1=CC=CC(=C1)C(=O)CBr |
Synonym | 2-bromo-1-3-methoxyphenyl ethanone,2-bromo-3'-methoxyacetophenone,m-methoxyphenacyl bromide,3'-methoxyphenacyl bromide,3-bromoacetyl anisole,2-bromo-1-3-methoxyphenyl ethan-1-one,3-methoxyphenacyl bromide,bromomethyl 3-methoxyphenyl ketone,ccris 7998,3-methoxyphenacylbromide |
IUPAC Name | 2-bromo-1-(3-methoxyphenyl)ethanone |
InChI Key | IOOHBIFQNQQUFI-UHFFFAOYSA-N |
Molecular Formula | C9H9BrO2 |