Cas no 112456-62-9 (Benzene, 1-chloro-4-[(S)-methylsulfinyl]-)
![Benzene, 1-chloro-4-[(S)-methylsulfinyl]- structure](https://ossimg.kuujia.com/scimg/112500/112456-62-9x500.png)
112456-62-9 structure
Product Name:Benzene, 1-chloro-4-[(S)-methylsulfinyl]-
CAS No:112456-62-9
MF:C7H7ClOS
MW:174.647879838943
CID:1203703
PubChem ID:11084383
Update Time:2025-04-20
Benzene, 1-chloro-4-[(S)-methylsulfinyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-chloro-4-[(S)-methylsulfinyl]-
- 1-Chloro-4-((S)-methylsulfinyl)benzene
- UNII-2KC6764B3Z
- Benzene, 1-chloro-4-((S)-methylsulfinyl)-
- (S)-p-Chlorophenyl methyl sulfoxide
- 4-Chlorophenyl methyl sulfoxide, (-)-
- 2KC6764B3Z
- (S)-4-chlorophenyl methyl sulfoxide
- 4-Chlorophenyl methyl sulfoxide, (S)-
- 112456-62-9
- SCHEMBL19079696
- Q27896850
-
- Inchi： 1S/C7H7ClOS/c1-10(9)7-4-2-6(8)3-5-7/h2-5H,1H3/t10-/m0/s1
- InChI Key： UBDUBBTYCRJUHW-JTQLQIEISA-N
- SMILES： ClC1C=CC(=CC=1)[S@](C)=O
Computed Properties
- Exact Mass: 173.99071
- Monoisotopic Mass: 173.9906137g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 130
- 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: 1.7
- Topological Polar Surface Area: 36.3?2
Experimental Properties
- PSA: 17.07
Benzene, 1-chloro-4-[(S)-methylsulfinyl]- Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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