Cas no 53870-35-2 (Benzenamine,4-(2-propen-1-ylsulfonyl)-)
53870-35-2 structure
Product Name:Benzenamine,4-(2-propen-1-ylsulfonyl)-
CAS No:53870-35-2
MF:C9H11NO2S
MW:197.2541410923
CID:386663
PubChem ID:239601
Update Time:2025-04-19
Benzenamine,4-(2-propen-1-ylsulfonyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine,4-(2-propen-1-ylsulfonyl)-
- 4-prop-2-enylsulfonylaniline
- 4-(Allylsulfonyl)aniline
- AG-670/31904055
- Oprea1_194619
- DTXSID70286334
- NSC44846
- NSC-44846
- SCHEMBL2148798
- 4-(allylsulfonyl)phenylamine
- AKOS003241669
- 53870-35-2
-
- Inchi: 1S/C9H11NO2S/c1-2-7-13(11,12)9-5-3-8(10)4-6-9/h2-6H,1,7,10H2
- InChI Key: RGIPTJCUMKROIK-UHFFFAOYSA-N
- SMILES: S(CC=C)(C1C=CC(=CC=1)N)(=O)=O
Computed Properties
- Exact Mass: 197.05113
- Monoisotopic Mass: 197.051
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 258
- 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: 1.1
- Topological Polar Surface Area: 68.5?2
Experimental Properties
- Density: 1.22
- Boiling Point: 396.6°Cat760mmHg
- Flash Point: 193.7°C
- Refractive Index: 1.567
- PSA: 60.16
- LogP: 2.89050
Benzenamine,4-(2-propen-1-ylsulfonyl)- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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