Home Sulfos [4-(methanesulfonylmethyl)phenyl]methanamine

[4-(methanesulfonylmethyl)phenyl]methanamine

CAS No.:
854304-24-8
Catalog Number:
AG00IDNX
Molecular Formula:
C9H13NO2S
Molecular Weight:
199.2700
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Product Description
Catalog Number:
AG00IDNX
Chemical Name:
[4-(methanesulfonylmethyl)phenyl]methanamine
CAS Number:
854304-24-8
Molecular Formula:
C9H13NO2S
Molecular Weight:
199.2700
MDL Number:
MFCD12912743
IUPAC Name:
[4-(methylsulfonylmethyl)phenyl]methanamine
InChI:
InChI=1S/C9H13NO2S/c1-13(11,12)7-9-4-2-8(6-10)3-5-9/h2-5H,6-7,10H2,1H3
InChI Key:
SZHQMBFLAZHRLB-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)CS(=O)(=O)C
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.067g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.268g/mol
Monoisotopic Mass:
199.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties