Home Sulfos 4-chloro-3-(methanesulfonylmethyl)aniline

4-chloro-3-(methanesulfonylmethyl)aniline

CAS No.:
1178024-93-5
Catalog Number:
AG01AJ3W
Molecular Formula:
C8H10ClNO2S
Molecular Weight:
219.6885
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Product Description
Catalog Number:
AG01AJ3W
Chemical Name:
4-chloro-3-(methanesulfonylmethyl)aniline
CAS Number:
1178024-93-5
Molecular Formula:
C8H10ClNO2S
Molecular Weight:
219.6885
MDL Number:
MFCD12823727
IUPAC Name:
4-chloro-3-(methylsulfonylmethyl)aniline
InChI:
InChI=1S/C8H10ClNO2S/c1-13(11,12)5-6-4-7(10)2-3-8(6)9/h2-4H,5,10H2,1H3
InChI Key:
RSOFQHQNZJOJJY-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1CS(=O)(=O)C)N
Properties
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.012g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.683g/mol
Monoisotopic Mass:
219.012g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties