Cas no 17530-80-2 (Benzene,1-chloro-4-[(phenylsulfinyl)methyl]-)
![Benzene,1-chloro-4-[(phenylsulfinyl)methyl]- structure](https://ossimg.kuujia.com/scimg/18000/17530-80-2x500.png)
17530-80-2 structure
Product Name:Benzene,1-chloro-4-[(phenylsulfinyl)methyl]-
CAS No:17530-80-2
MF:C13H11ClOS
MW:250.743841409683
CID:143616
PubChem ID:228204
Update Time:2025-04-19
Benzene,1-chloro-4-[(phenylsulfinyl)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-chloro-4-[(phenylsulfinyl)methyl]-
- 1-(benzenesulfinylmethyl)-4-chlorobenzene
- 1-(benzenesulfinylmethyl)-4-chloro-benzene
- (4-Chlor-benzyl)-phenyl-sulfoxid
- (4-chloro-benzyl)-phenyl sulfoxide
- 1-chloro-4-((phenylsulfinyl)methyl)benzen
- 1-chloro-4-(phenylsulfinylmethyl)benzene
- 1-chloro-4-[(phenylsulfinyl)methyl]benzene
- AC1L5G1T
- AC1Q3NX7
- AR-1C2404
- CTK4D5885
- HMS3086B15
- NSC20883
- p-Chlorbenzyl-phenyl-sulfoxid
- Phenyl-(4-chlor-benzyl)-sulfoxid
- Phenyl-4-chlor-benzyl-sulfoxid
- NSC-20883
- 17530-80-2
- DTXSID40281230
- CHEMBL1895054
- MLS002638755
- SMR001548221
-
- Inchi： 1S/C13H11ClOS/c14-12-8-6-11(7-9-12)10-16(15)13-4-2-1-3-5-13/h1-9H,10H2
- InChI Key： DMXKWWLFOPKKAW-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)CS(C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 250.02203
- Monoisotopic Mass: 250.022
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 230
- 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: 3.3
- Topological Polar Surface Area: 36.3?2
Experimental Properties
- Density: 1.33
- Boiling Point: 424.4°Cat760mmHg
- Flash Point: 210.5°C
- Refractive Index: 1.662
- PSA: 23.06
- LogP: 4.51350
Benzene,1-chloro-4-[(phenylsulfinyl)methyl]- Related Literature
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
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
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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