Home Sulfos 1-((2-Chloroethyl)sulfonyl)-4-methylbenzene

1-((2-Chloroethyl)sulfonyl)-4-methylbenzene

CAS No.:
22381-53-9
Catalog Number:
AG003H2H
Molecular Formula:
C9H11ClO2S
Molecular Weight:
218.7004
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Product Description
Catalog Number:
AG003H2H
Chemical Name:
1-((2-Chloroethyl)sulfonyl)-4-methylbenzene
CAS Number:
22381-53-9
Molecular Formula:
C9H11ClO2S
Molecular Weight:
218.7004
MDL Number:
MFCD00139140
IUPAC Name:
1-(2-chloroethylsulfonyl)-4-methylbenzene
InChI:
InChI=1S/C9H11ClO2S/c1-8-2-4-9(5-3-8)13(11,12)7-6-10/h2-5H,6-7H2,1H3
InChI Key:
KUAGAJLNIOIGRN-UHFFFAOYSA-N
SMILES:
ClCCS(=O)(=O)c1ccc(cc1)C
NSC Number:
9012
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.017g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.695g/mol
Monoisotopic Mass:
218.017g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties