Cas no 442914-24-1 (Butanoic acid, 2-[(4-chlorophenyl)sulfonyl]-)
![Butanoic acid, 2-[(4-chlorophenyl)sulfonyl]- structure](https://ossimg.kuujia.com/scimg/443000/442914-24-1x500.png)
442914-24-1 structure
Product Name:Butanoic acid, 2-[(4-chlorophenyl)sulfonyl]-
CAS No:442914-24-1
MF:C10H11ClO4S
MW:262.709941148758
CID:2643052
PubChem ID:12097764
Update Time:2025-04-21
Butanoic acid, 2-[(4-chlorophenyl)sulfonyl]- Chemical and Physical Properties
Names and Identifiers
-
- 2-(4-chlorophenyl)sulfonylbutanoic acid
- Butanoic acid, 2-[(4-chlorophenyl)sulfonyl]-
- 442914-24-1
- DTXSID00477516
-
- Inchi： 1S/C10H11ClO4S/c1-2-9(10(12)13)16(14,15)8-5-3-7(11)4-6-8/h3-6,9H,2H2,1H3,(H,12,13)
- InChI Key： HGCASONBUAQDIP-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)S(C(C(=O)O)CC)(=O)=O
Computed Properties
- Exact Mass: 262.0066577Da
- Monoisotopic Mass: 262.0066577Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 338
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 79.8?2
Butanoic acid, 2-[(4-chlorophenyl)sulfonyl]- Related Literature
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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