Cas no 20246-02-0 (Benzene, [(R)-(phenylmethyl)sulfinyl]-)
20246-02-0 structure
Product Name:Benzene, [(R)-(phenylmethyl)sulfinyl]-
CAS No:20246-02-0
MF:C13H12OS
MW:216.298782348633
CID:1392436
PubChem ID:12228219
Update Time:2025-04-20
Benzene, [(R)-(phenylmethyl)sulfinyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, [(R)-(phenylmethyl)sulfinyl]-
- [(R)-phenylsulfinyl]methylbenzene
- DTXSID90481405
- 20246-02-0
-
- Inchi: 1S/C13H12OS/c14-15(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H2/t15-/m1/s1
- InChI Key: FBPGAWABXWMRAR-OAHLLOKOSA-N
- SMILES: [S@](C1C=CC=CC=1)(CC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 216.06096
- Monoisotopic Mass: 216.06088618g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 203
- 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: 2.6
- Topological Polar Surface Area: 36.3?2
Experimental Properties
- PSA: 17.07
- LogP: 3.86010
Benzene, [(R)-(phenylmethyl)sulfinyl]- Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
20246-02-0 (Benzene, [(R)-(phenylmethyl)sulfinyl]-) Related Products
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