Cas no 54582-24-0 (Ethanone, 1-(4-chlorophenyl)-, oxime, (1E)-)
54582-24-0 structure
Product Name:Ethanone, 1-(4-chlorophenyl)-, oxime, (1E)-
CAS No:54582-24-0
MF:C8H8ClNO
MW:169.608221054077
CID:354194
PubChem ID:5399157
Update Time:2025-04-19
Ethanone, 1-(4-chlorophenyl)-, oxime, (1E)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-(4-chlorophenyl)-, oxime, (1E)-
- J-502574
- (1E)-1-(4-chlorophenyl)ethanone oxime
- 1-(4-chlorophenyl)-1-ethanone oxime
- 1-(4-Chlorophenyl)ethanone oxime
- NSC57600
- NSC-57600
- C13043
- N-[1-(4-chlorophenyl)ethylidene]hydroxylamine
- DTXSID601288031
- BAA95639
- 1-(4-chlorophenyl)-ethanone oxime
- KAXTWDXRCMICEQ-POHAHGRESA-N
- 4-Chloroacetophenone oxime
- 1956-39-4
- MFCD00033237
- (Z)-1-(4-chlorophenyl)ethanone oxime
- KAXTWDXRCMICEQ-UXBLZVDNSA-N
- CHEMBL136025
- 4'-Chloroacetophenoxime; Methyl 4-chlorophenyl ketoxime; NSC 57600
- 54582-24-0
- (NE)-N-[1-(4-chlorophenyl)ethylidene]hydroxylamine
- p-Chloroacetophenone oxime
- SCHEMBL265248
- HMS1365J04
- 4'-Chloroacetophenone oxime
- 1-(4-Chloro-phenyl)-ethanone oxime
- AKOS000307979
- 1-(4-Chlorophenyl)ethanoneoxime
- (Z)-N-[1-(4-chlorophenyl)ethylidene]hydroxylamine
- (E)-1-(4-chlorophenyl)ethan-1-one oxime
-
- MDL： MFCD00033237
- Inchi： 1S/C8H8ClNO/c1-6(10-11)7-2-4-8(9)5-3-7/h2-5,11H,1H3/b10-6+
- InChI Key： KAXTWDXRCMICEQ-UXBLZVDNSA-N
- SMILES： ClC1C=CC(=CC=1)/C(/C)=N/O
Computed Properties
- Exact Mass: 169.02954
- Monoisotopic Mass: 169.0294416g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 150
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.5
- Topological Polar Surface Area: 32.6?2
Experimental Properties
- PSA: 32.59
Ethanone, 1-(4-chlorophenyl)-, oxime, (1E)- Related Literature
-
Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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