Cas no 31982-00-0 (Benzenesulfonamide,N-[(1S)-3-chloro-1-methyl-2-oxopropyl]-4-methyl-)
![Benzenesulfonamide,N-[(1S)-3-chloro-1-methyl-2-oxopropyl]-4-methyl- structure](https://ossimg.kuujia.com/scimg/32000/31982-00-0x500.png)
31982-00-0 structure
Product Name:Benzenesulfonamide,N-[(1S)-3-chloro-1-methyl-2-oxopropyl]-4-methyl-
CAS No:31982-00-0
MF:C11H14ClNO3S
MW:275.751760959625
CID:305830
PubChem ID:208314
Update Time:2025-04-19
Benzenesulfonamide,N-[(1S)-3-chloro-1-methyl-2-oxopropyl]-4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonamide,N-[(1S)-3-chloro-1-methyl-2-oxopropyl]-4-methyl-
- L-N-(3-Chloro-1-methylacetonyl)-p-toluenesulfonamide
- N-(4-Chloro-3-oxobutan-2-yl)-4-methylbenzene-1-sulfonamide
- p-Toluenesulfonamide, N-(3-chloro-1-methylacetonyl)-, L-
- Benzenesulfonamide, N-(3-chloro-1-methyl-2-oxopropyl)-4-methyl-, (S)-
- DTXSID50953875
- N-Tosyl-L-alanine chloromethyl ketone
- 31982-00-0
-
- Inchi： 1S/C11H14ClNO3S/c1-8-3-5-10(6-4-8)17(15,16)13-9(2)11(14)7-12/h3-6,9,13H,7H2,1-2H3/t9-/m0/s1
- InChI Key： IPACIBZWFYEXRK-VIFPVBQESA-N
- SMILES： ClCC([C@H](C)NS(C1C=CC(C)=CC=1)(=O)=O)=O
Computed Properties
- Exact Mass: 275.03842
- Monoisotopic Mass: 275.0382922g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 355
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 71.6?2
Experimental Properties
- PSA: 63.24
Benzenesulfonamide,N-[(1S)-3-chloro-1-methyl-2-oxopropyl]-4-methyl- Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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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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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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