Cas no 16063-20-0 (Ethanone, 2-chloro-1-[2-(methylamino)phenyl]- (9CI))
![Ethanone, 2-chloro-1-[2-(methylamino)phenyl]- (9CI) structure](https://ossimg.kuujia.com/scimg/16500/16063-20-0x500.png)
16063-20-0 structure
Product Name:Ethanone, 2-chloro-1-[2-(methylamino)phenyl]- (9CI)
CAS No:16063-20-0
MF:C9H10ClNO
MW:183.634801387787
CID:1339826
PubChem ID:19824938
Update Time:2025-04-20
Ethanone, 2-chloro-1-[2-(methylamino)phenyl]- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 2-chloro-1-[2-(methylamino)phenyl]- (9CI)
- 2-chloro-1-[2-(methylamino)phenyl]ethanone
- ETHANONE, 2-CHLORO-1-[2-(METHYLAMINO)PHENYL]-
- 2-Chloro-1-[2-(methylamino)phenyl]ethan-1-one
- SCHEMBL9796404
- XROLSOVOGKFCFQ-UHFFFAOYSA-N
- DB-276514
- 2-chloro-2'-(methylamino)acetophenone
- DTXSID50600352
- 16063-20-0
-
- Inchi： 1S/C9H10ClNO/c1-11-8-5-3-2-4-7(8)9(12)6-10/h2-5,11H,6H2,1H3
- InChI Key： XROLSOVOGKFCFQ-UHFFFAOYSA-N
- SMILES： ClCC(C1C=CC=CC=1NC)=O
Computed Properties
- Exact Mass: 183.0452
- Monoisotopic Mass: 183.0450916g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 161
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
Ethanone, 2-chloro-1-[2-(methylamino)phenyl]- (9CI) Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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