Carbonyl compounds
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Pifithrin-alpha, p-Nitro hydrobromide, Thermo Scientific Chemicals
CAS: 389850-21-9 Molecular Formula: C15H16BrN3O3S Molecular Weight (g/mol): 398.275 MDL Number: MFCD00398180 InChI Key: NXPCMOGORSWOLH-UHFFFAOYSA-N Synonym: pifithrin-alpha, p-nitro,1-4-nitrophenyl-2-4,5,6,7-tetrahydro-2-imino-3 2h-benzothiazolyl ethanone, hbr,pifithrin-alpha, p-nitro hydrobromide,2-2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl-1-4-nitrophenyl ethanone hydrobromide,2-2-imino-4,5,6,7-tetrahydrobenzo d thiazol-3 2h-yl-1-4-nitrophenyl ethanone hbr,2-2-imino-4,5,6,7-tetrahydrobenzo d thiazol-3 2h-yl-1-4-nitrophenyl ethanone hydrobromide PubChem CID: 11553038 IUPAC Name: 2-(2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-nitrophenyl)ethanone;hydrobromide SMILES: C1CCC2=C(C1)N(C(=N)S2)CC(=O)C3=CC=C(C=C3)[N+](=O)[O-].Br
| PubChem CID | 11553038 |
|---|---|
| CAS | 389850-21-9 |
| Molecular Weight (g/mol) | 398.275 |
| MDL Number | MFCD00398180 |
| SMILES | C1CCC2=C(C1)N(C(=N)S2)CC(=O)C3=CC=C(C=C3)[N+](=O)[O-].Br |
| Synonym | pifithrin-alpha, p-nitro,1-4-nitrophenyl-2-4,5,6,7-tetrahydro-2-imino-3 2h-benzothiazolyl ethanone, hbr,pifithrin-alpha, p-nitro hydrobromide,2-2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl-1-4-nitrophenyl ethanone hydrobromide,2-2-imino-4,5,6,7-tetrahydrobenzo d thiazol-3 2h-yl-1-4-nitrophenyl ethanone hbr,2-2-imino-4,5,6,7-tetrahydrobenzo d thiazol-3 2h-yl-1-4-nitrophenyl ethanone hydrobromide |
| IUPAC Name | 2-(2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-nitrophenyl)ethanone;hydrobromide |
| InChI Key | NXPCMOGORSWOLH-UHFFFAOYSA-N |
| Molecular Formula | C15H16BrN3O3S |
4-Aminopyridine-3-carboxaldehyde, 95%
CAS: 42373-30-8 Molecular Formula: C6H7N2O Molecular Weight (g/mol): 123.13 MDL Number: MFCD04038972 InChI Key: GTPZHMGXKZIHKW-UHFFFAOYSA-O Synonym: 4-aminonicotinaldehyde,4-amino-3-formylpyridine,4-amino-pyridine-3-carbaldehyde,4-aminopyridine-3-carboxaldehyde,4-amino-3-pyridinecarboxaldehyde,4-amino-pyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 4-amino,zlchem 837,pubchem7681,acmc-1aqvh PubChem CID: 2761033 IUPAC Name: 4-aminopyridine-3-carbaldehyde SMILES: NC1=CC=[NH+]C=C1C=O
| PubChem CID | 2761033 |
|---|---|
| CAS | 42373-30-8 |
| Molecular Weight (g/mol) | 123.13 |
| MDL Number | MFCD04038972 |
| SMILES | NC1=CC=[NH+]C=C1C=O |
| Synonym | 4-aminonicotinaldehyde,4-amino-3-formylpyridine,4-amino-pyridine-3-carbaldehyde,4-aminopyridine-3-carboxaldehyde,4-amino-3-pyridinecarboxaldehyde,4-amino-pyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 4-amino,zlchem 837,pubchem7681,acmc-1aqvh |
| IUPAC Name | 4-aminopyridine-3-carbaldehyde |
| InChI Key | GTPZHMGXKZIHKW-UHFFFAOYSA-O |
| Molecular Formula | C6H7N2O |
3-[(Benzyloxycarbonyl)amino]propionaldehyde, 95%
CAS: 65564-05-8 Molecular Formula: C11H13NO3 Molecular Weight (g/mol): 207.23 MDL Number: MFCD05664298 InChI Key: PQMOZOQTXKMYSK-UHFFFAOYSA-N Synonym: benzyl 3-oxopropylcarbamate,3-benzyloxycarbonyl amino-1-propanal,3-benzyloxycarbonyl amino propionaldehyde,benzyl n-3-oxopropyl carbamate,benzyl 3-oxopropyl carbamate,3-oxo-propyl-carbamic acid benzyl ester,n-phenylmethoxycarbonyl-3-aminopropanal,n-cbz-3-aminopropanal,pubchem13633 PubChem CID: 10398106 IUPAC Name: benzyl N-(3-oxopropyl)carbamate SMILES: C1=CC=C(C=C1)COC(=O)NCCC=O
| PubChem CID | 10398106 |
|---|---|
| CAS | 65564-05-8 |
| Molecular Weight (g/mol) | 207.23 |
| MDL Number | MFCD05664298 |
| SMILES | C1=CC=C(C=C1)COC(=O)NCCC=O |
| Synonym | benzyl 3-oxopropylcarbamate,3-benzyloxycarbonyl amino-1-propanal,3-benzyloxycarbonyl amino propionaldehyde,benzyl n-3-oxopropyl carbamate,benzyl 3-oxopropyl carbamate,3-oxo-propyl-carbamic acid benzyl ester,n-phenylmethoxycarbonyl-3-aminopropanal,n-cbz-3-aminopropanal,pubchem13633 |
| IUPAC Name | benzyl N-(3-oxopropyl)carbamate |
| InChI Key | PQMOZOQTXKMYSK-UHFFFAOYSA-N |
| Molecular Formula | C11H13NO3 |
3-Bromo-5-chloro-2-hydroxybenzaldehyde, 97%
CAS: 19652-32-5 Molecular Formula: C7H4BrClO2 Molecular Weight (g/mol): 235.461 MDL Number: MFCD00051690 InChI Key: KNOYZLVIXXBBIB-UHFFFAOYSA-N Synonym: 3-bromo-5-chlorosalicylaldehyde,3-bromo-5-chlorosalicylic aldehyde,benzaldehyde, 3-bromo-5-chloro-2-hydroxy,3-bromo-5-chloro salicyclic aldehyde,3-bromo-5-chloro-2-hydroxy-benzaldehyde,3-bromo-5-chloro-o-hydroxybenzaldehyde,pubchem3591,acmc-1bs9s,akos bb-6948,knoyzlvixxbbib-uhfffaoysa PubChem CID: 519676 IUPAC Name: 3-bromo-5-chloro-2-hydroxybenzaldehyde SMILES: C1=C(C=C(C(=C1Br)O)C=O)Cl
| PubChem CID | 519676 |
|---|---|
| CAS | 19652-32-5 |
| Molecular Weight (g/mol) | 235.461 |
| MDL Number | MFCD00051690 |
| SMILES | C1=C(C=C(C(=C1Br)O)C=O)Cl |
| Synonym | 3-bromo-5-chlorosalicylaldehyde,3-bromo-5-chlorosalicylic aldehyde,benzaldehyde, 3-bromo-5-chloro-2-hydroxy,3-bromo-5-chloro salicyclic aldehyde,3-bromo-5-chloro-2-hydroxy-benzaldehyde,3-bromo-5-chloro-o-hydroxybenzaldehyde,pubchem3591,acmc-1bs9s,akos bb-6948,knoyzlvixxbbib-uhfffaoysa |
| IUPAC Name | 3-bromo-5-chloro-2-hydroxybenzaldehyde |
| InChI Key | KNOYZLVIXXBBIB-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrClO2 |
2-(Cyclopropylmethoxy)pyridine-3-carboxaldehyde, 97%
CAS: 902835-88-5 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.203 MDL Number: MFCD07781136 InChI Key: AEOXNPSSZSDLDK-UHFFFAOYSA-N Synonym: 2-cyclopropylmethoxy nicotinaldehyde,2-cyclopropylmethoxy pyridine-3-carbaldehyde,2-cyclopropylmethoxy pyridine-3-carboxaldehyde,2-cyclopropylmethoxy-pyridine-3-carbaldehyde,2-cyclopropyl-methoxy pyridine-3-carbaldehyde PubChem CID: 42553129 IUPAC Name: 2-(cyclopropylmethoxy)pyridine-3-carbaldehyde SMILES: C1CC1COC2=C(C=CC=N2)C=O
| PubChem CID | 42553129 |
|---|---|
| CAS | 902835-88-5 |
| Molecular Weight (g/mol) | 177.203 |
| MDL Number | MFCD07781136 |
| SMILES | C1CC1COC2=C(C=CC=N2)C=O |
| Synonym | 2-cyclopropylmethoxy nicotinaldehyde,2-cyclopropylmethoxy pyridine-3-carbaldehyde,2-cyclopropylmethoxy pyridine-3-carboxaldehyde,2-cyclopropylmethoxy-pyridine-3-carbaldehyde,2-cyclopropyl-methoxy pyridine-3-carbaldehyde |
| IUPAC Name | 2-(cyclopropylmethoxy)pyridine-3-carbaldehyde |
| InChI Key | AEOXNPSSZSDLDK-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO2 |
2-Bromo-2',4'-dichloroacetophenone, 95%
CAS: 2631-72-3 Molecular Formula: C8H5BrCl2O Molecular Weight (g/mol): 267.931 MDL Number: MFCD00053005 InChI Key: DASJDMQCPIDJIF-UHFFFAOYSA-N Synonym: 2-bromo-2',4'-dichloroacetophenone,2-bromo-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl bromide,2-bromo-1-2,4-dichlorophenyl ethan-1-one,2-bromo-1-2,4-dichloro-phenyl-ethanone,ethanone, 2-bromo-1-2,4-dichlorophenyl,2'-bromo-2,4-dichloro acetophenone,omega-bromo-2,4-dichloro acetophenone,2',4'-dichlorophenacyl bromide,2-bromo-2,4-dichloroacetophenone PubChem CID: 75828 IUPAC Name: 2-bromo-1-(2,4-dichlorophenyl)ethanone SMILES: C1=CC(=C(C=C1Cl)Cl)C(=O)CBr
| PubChem CID | 75828 |
|---|---|
| CAS | 2631-72-3 |
| Molecular Weight (g/mol) | 267.931 |
| MDL Number | MFCD00053005 |
| SMILES | C1=CC(=C(C=C1Cl)Cl)C(=O)CBr |
| Synonym | 2-bromo-2',4'-dichloroacetophenone,2-bromo-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl bromide,2-bromo-1-2,4-dichlorophenyl ethan-1-one,2-bromo-1-2,4-dichloro-phenyl-ethanone,ethanone, 2-bromo-1-2,4-dichlorophenyl,2'-bromo-2,4-dichloro acetophenone,omega-bromo-2,4-dichloro acetophenone,2',4'-dichlorophenacyl bromide,2-bromo-2,4-dichloroacetophenone |
| IUPAC Name | 2-bromo-1-(2,4-dichlorophenyl)ethanone |
| InChI Key | DASJDMQCPIDJIF-UHFFFAOYSA-N |
| Molecular Formula | C8H5BrCl2O |
2-(Trifluoromethyl)pyridine-5-carboxaldehyde, 95%
CAS: 386704-12-7 Molecular Formula: C7H4F3NO Molecular Weight (g/mol): 175.11 MDL Number: MFCD01862647 InChI Key: MRPAGRCGPAXOGS-UHFFFAOYSA-N Synonym: 6-trifluoromethyl pyridine-3-carboxaldehyde,6-trifluoromethyl nicotinaldehyde,2-trifluoromethyl pyridine-5-carboxaldehyde,6-trifluoromethyl pyridine-3-carbaldehyde,5-formyl-2-trifluoromethyl pyridine,3-pyridinecarboxaldehyde, 6-trifluoromethyl,6-trifluoromethyl-pyridine-3-carbaldehyde,6-trifluoromethyl-3-pyridinecarboxaldehyde,2-trifluoromethyl pyridine-5-carbaldehyde,pubchem15866 PubChem CID: 2777762 IUPAC Name: 6-(trifluoromethyl)pyridine-3-carbaldehyde SMILES: FC(F)(F)C1=NC=C(C=O)C=C1
| PubChem CID | 2777762 |
|---|---|
| CAS | 386704-12-7 |
| Molecular Weight (g/mol) | 175.11 |
| MDL Number | MFCD01862647 |
| SMILES | FC(F)(F)C1=NC=C(C=O)C=C1 |
| Synonym | 6-trifluoromethyl pyridine-3-carboxaldehyde,6-trifluoromethyl nicotinaldehyde,2-trifluoromethyl pyridine-5-carboxaldehyde,6-trifluoromethyl pyridine-3-carbaldehyde,5-formyl-2-trifluoromethyl pyridine,3-pyridinecarboxaldehyde, 6-trifluoromethyl,6-trifluoromethyl-pyridine-3-carbaldehyde,6-trifluoromethyl-3-pyridinecarboxaldehyde,2-trifluoromethyl pyridine-5-carbaldehyde,pubchem15866 |
| IUPAC Name | 6-(trifluoromethyl)pyridine-3-carbaldehyde |
| InChI Key | MRPAGRCGPAXOGS-UHFFFAOYSA-N |
| Molecular Formula | C7H4F3NO |
2-Bromoacetophenone, 98%
CAS: 70-11-1 Molecular Formula: C8H7BrO Molecular Weight (g/mol): 199.047 MDL Number: MFCD00000195 InChI Key: LIGACIXOYTUXAW-UHFFFAOYSA-N Synonym: 2-bromoacetophenone,phenacyl bromide,2-bromo-1-phenylethan-1-one,bromoacetophenone,ethanone, 2-bromo-1-phenyl,bromomethyl phenyl ketone,alpha-bromoacetophenone,stauffer 4644,omega-bromoacetophenone,acetophenone, 2-bromo PubChem CID: 6259 ChEBI: CHEBI:51846 IUPAC Name: 2-bromo-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)CBr
| PubChem CID | 6259 |
|---|---|
| CAS | 70-11-1 |
| Molecular Weight (g/mol) | 199.047 |
| ChEBI | CHEBI:51846 |
| MDL Number | MFCD00000195 |
| SMILES | C1=CC=C(C=C1)C(=O)CBr |
| Synonym | 2-bromoacetophenone,phenacyl bromide,2-bromo-1-phenylethan-1-one,bromoacetophenone,ethanone, 2-bromo-1-phenyl,bromomethyl phenyl ketone,alpha-bromoacetophenone,stauffer 4644,omega-bromoacetophenone,acetophenone, 2-bromo |
| IUPAC Name | 2-bromo-1-phenylethanone |
| InChI Key | LIGACIXOYTUXAW-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO |
2,2-Difluoroacetophenone, 95%
CAS: 395-01-7 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.132 MDL Number: MFCD06246879 InChI Key: OLYKCPDTXVZOQF-UHFFFAOYSA-N Synonym: 2,2-difluoroacetophenone,alpha,alpha-difluoroacetophenone,2,2-difluoro-1-phenyl-ethanone,2,2-difluoro-1-phenylethan-1-one,a,a-difluoroacetophenone,ethanone, 2,2-difluoro-1-phenyl,difluoromethyl phenyl ketone,difluoroacetophenone,acmc-20aojw,acetophenone, 2,2-difluoro PubChem CID: 273286 IUPAC Name: 2,2-difluoro-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)C(F)F
| PubChem CID | 273286 |
|---|---|
| CAS | 395-01-7 |
| Molecular Weight (g/mol) | 156.132 |
| MDL Number | MFCD06246879 |
| SMILES | C1=CC=C(C=C1)C(=O)C(F)F |
| Synonym | 2,2-difluoroacetophenone,alpha,alpha-difluoroacetophenone,2,2-difluoro-1-phenyl-ethanone,2,2-difluoro-1-phenylethan-1-one,a,a-difluoroacetophenone,ethanone, 2,2-difluoro-1-phenyl,difluoromethyl phenyl ketone,difluoroacetophenone,acmc-20aojw,acetophenone, 2,2-difluoro |
| IUPAC Name | 2,2-difluoro-1-phenylethanone |
| InChI Key | OLYKCPDTXVZOQF-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O |
4-Bromosalicylaldehyde, 97%
CAS: 22532-62-3 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.019 MDL Number: MFCD06252606 InChI Key: HXTWKHXDFATMSP-UHFFFAOYSA-N Synonym: 4-bromosalicylaldehyde,4-bromo-2-hydroxy-benzaldehyde,2-hydroxy-4-bromobenzaldehyde,benzaldehyde, 4-bromo-2-hydroxy,4-bromo-2-hydroxybenzaldheyde,4-bromosalicyladehyde,pubchem16944,acmc-1cq5t,intermediates-zcf02605,4-bromo-2-hydroxybenaldehyde PubChem CID: 4066019 IUPAC Name: 4-bromo-2-hydroxybenzaldehyde SMILES: C1=CC(=C(C=C1Br)O)C=O
| PubChem CID | 4066019 |
|---|---|
| CAS | 22532-62-3 |
| Molecular Weight (g/mol) | 201.019 |
| MDL Number | MFCD06252606 |
| SMILES | C1=CC(=C(C=C1Br)O)C=O |
| Synonym | 4-bromosalicylaldehyde,4-bromo-2-hydroxy-benzaldehyde,2-hydroxy-4-bromobenzaldehyde,benzaldehyde, 4-bromo-2-hydroxy,4-bromo-2-hydroxybenzaldheyde,4-bromosalicyladehyde,pubchem16944,acmc-1cq5t,intermediates-zcf02605,4-bromo-2-hydroxybenaldehyde |
| IUPAC Name | 4-bromo-2-hydroxybenzaldehyde |
| InChI Key | HXTWKHXDFATMSP-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO2 |
Malonyl dichloride, 94%
CAS: 1663-67-8 Molecular Formula: C3H2Cl2O2 Molecular Weight (g/mol): 140.947 MDL Number: MFCD00000735 InChI Key: SXYFKXOFMCIXQW-UHFFFAOYSA-N Synonym: malonyl chloride,malonyl dichloride,malonoyl chloride,malonic acid dichloride,malonoyl dichloride,malonic acid chloride,malonylchloride,methane-1,1-dicarbonyl chloride,malonylchlorid,malonyldichloride PubChem CID: 74269 IUPAC Name: propanedioyl dichloride SMILES: C(C(=O)Cl)C(=O)Cl
| PubChem CID | 74269 |
|---|---|
| CAS | 1663-67-8 |
| Molecular Weight (g/mol) | 140.947 |
| MDL Number | MFCD00000735 |
| SMILES | C(C(=O)Cl)C(=O)Cl |
| Synonym | malonyl chloride,malonyl dichloride,malonoyl chloride,malonic acid dichloride,malonoyl dichloride,malonic acid chloride,malonylchloride,methane-1,1-dicarbonyl chloride,malonylchlorid,malonyldichloride |
| IUPAC Name | propanedioyl dichloride |
| InChI Key | SXYFKXOFMCIXQW-UHFFFAOYSA-N |
| Molecular Formula | C3H2Cl2O2 |
LiChropur™ 2-Bromoacetophenone, For GC derivatization, ≥99.0%, MilliporeSigma™ Supelco™
MDL Number: MFCD00000195 Synonym: omega-Bromoacetophenone; Phenacyl bromide
| MDL Number | MFCD00000195 |
|---|---|
| Synonym | omega-Bromoacetophenone; Phenacyl bromide |
Ethyl hydrogen malonate, 90+%
CAS: 1071-46-1 Molecular Formula: C5H8O4 Molecular Weight (g/mol): 132.115 MDL Number: MFCD00020490 InChI Key: HGINADPHJQTSKN-UHFFFAOYSA-N Synonym: ethyl hydrogen malonate,monoethyl malonate,monoethyl malonic acid,mono-ethyl malonate,monoethyl hydrogen malonate,malonic acid monoethyl ester,ethoxycarbonyl acetic acid,2-ethoxycarbonyl acetic acid,3-ethoxy-3-oxo-propanoic acid,ethylhydrogenmalonate PubChem CID: 70615 ChEBI: CHEBI:86907 IUPAC Name: 3-ethoxy-3-oxopropanoic acid SMILES: CCOC(=O)CC(=O)O
| PubChem CID | 70615 |
|---|---|
| CAS | 1071-46-1 |
| Molecular Weight (g/mol) | 132.115 |
| ChEBI | CHEBI:86907 |
| MDL Number | MFCD00020490 |
| SMILES | CCOC(=O)CC(=O)O |
| Synonym | ethyl hydrogen malonate,monoethyl malonate,monoethyl malonic acid,mono-ethyl malonate,monoethyl hydrogen malonate,malonic acid monoethyl ester,ethoxycarbonyl acetic acid,2-ethoxycarbonyl acetic acid,3-ethoxy-3-oxo-propanoic acid,ethylhydrogenmalonate |
| IUPAC Name | 3-ethoxy-3-oxopropanoic acid |
| InChI Key | HGINADPHJQTSKN-UHFFFAOYSA-N |
| Molecular Formula | C5H8O4 |
4'-(Trifluoromethyl)acetophenone, 98+%
CAS: 709-63-7 Molecular Formula: C9H7F3O Molecular Weight (g/mol): 188.149 MDL Number: MFCD00000401 InChI Key: HHAISVSEJFEWBZ-UHFFFAOYSA-N Synonym: 4'-trifluoromethyl acetophenone,1-4-trifluoromethyl phenyl ethanone,1-4-trifluoromethyl phenyl ethan-1-one,4-trifluoromethylacetophenone,4-acetylbenzotrifluoride,4-trifluoromethyl acetophenone,p-trifluoromethylacetophenone,4'-trifluoromethylacetophenone,ethanone, 1-4-trifluoromethyl phenyl PubChem CID: 69731 IUPAC Name: 1-[4-(trifluoromethyl)phenyl]ethanone SMILES: CC(=O)C1=CC=C(C=C1)C(F)(F)F
| PubChem CID | 69731 |
|---|---|
| CAS | 709-63-7 |
| Molecular Weight (g/mol) | 188.149 |
| MDL Number | MFCD00000401 |
| SMILES | CC(=O)C1=CC=C(C=C1)C(F)(F)F |
| Synonym | 4'-trifluoromethyl acetophenone,1-4-trifluoromethyl phenyl ethanone,1-4-trifluoromethyl phenyl ethan-1-one,4-trifluoromethylacetophenone,4-acetylbenzotrifluoride,4-trifluoromethyl acetophenone,p-trifluoromethylacetophenone,4'-trifluoromethylacetophenone,ethanone, 1-4-trifluoromethyl phenyl |
| IUPAC Name | 1-[4-(trifluoromethyl)phenyl]ethanone |
| InChI Key | HHAISVSEJFEWBZ-UHFFFAOYSA-N |
| Molecular Formula | C9H7F3O |
3'-Chloroacetophenone, 98+%
CAS: 99-02-5 Molecular Formula: C8H7ClO Molecular Weight (g/mol): 154.59 MDL Number: MFCD00000593 InChI Key: UUWJBXKHMMQDED-UHFFFAOYSA-N Synonym: 3'-chloroacetophenone,1-3-chlorophenyl ethanone,m-chloroacetophenone,ethanone, 1-3-chlorophenyl,3-chloroacetophenone,1-3-chlorophenyl ethan-1-one,3-chloro-acetophenone,acetophenone, 3'-chloro,1-3-chloro-phenyl-ethanone,3/'-chloroacetophenone PubChem CID: 14933 IUPAC Name: 1-(3-chlorophenyl)ethanone SMILES: CC(=O)C1=CC=CC(Cl)=C1
| PubChem CID | 14933 |
|---|---|
| CAS | 99-02-5 |
| Molecular Weight (g/mol) | 154.59 |
| MDL Number | MFCD00000593 |
| SMILES | CC(=O)C1=CC=CC(Cl)=C1 |
| Synonym | 3'-chloroacetophenone,1-3-chlorophenyl ethanone,m-chloroacetophenone,ethanone, 1-3-chlorophenyl,3-chloroacetophenone,1-3-chlorophenyl ethan-1-one,3-chloro-acetophenone,acetophenone, 3'-chloro,1-3-chloro-phenyl-ethanone,3/'-chloroacetophenone |
| IUPAC Name | 1-(3-chlorophenyl)ethanone |
| InChI Key | UUWJBXKHMMQDED-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO |