Cas no 817209-18-0 (Ethanone,1-(2-amino-3-chloro-4-methylphenyl)-)
817209-18-0 structure
Product Name:Ethanone,1-(2-amino-3-chloro-4-methylphenyl)-
CAS No:817209-18-0
MF:C9H10ClNO
MW:183.634801387787
CID:715567
PubChem ID:46835495
Update Time:2025-04-19
Ethanone,1-(2-amino-3-chloro-4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,1-(2-amino-3-chloro-4-methylphenyl)-
- 1-(2-amino-3-chloro-4-methylphenyl)ethanone
- 817209-18-0
- Ethanone, 1-(2-amino-3-chloro-4-methylphenyl)-
- DTXSID80676429
- AKOS006306173
- 1-(2-Amino-3-chloro-4-methylphenyl)ethan-1-one
- 1-(2-amino-3-chloro-4-methylphenyl)-Ethanone
-
- Inchi： 1S/C9H10ClNO/c1-5-3-4-7(6(2)12)9(11)8(5)10/h3-4H,11H2,1-2H3
- InChI Key： SYQWAHAWWZTXQZ-UHFFFAOYSA-N
- SMILES： ClC1=C(C)C=CC(C(C)=O)=C1N
Computed Properties
- Exact Mass: 183.0450916g/mol
- 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: 1
- Complexity: 183
- 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: 2.5
- Topological Polar Surface Area: 43.1?2
Ethanone,1-(2-amino-3-chloro-4-methylphenyl)- Related Literature
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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