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129872-50-0 | Methanesulfonamide, N-[4-(aminomethyl)phenyl]-
CAS No: 129872-50-0 Catalog No: AG000TR5 MDL No:MFCD06212900
Product Description
Catalog Number:
AG000TR5
Chemical Name:
Methanesulfonamide, N-[4-(aminomethyl)phenyl]-
CAS Number:
129872-50-0
Molecular Formula:
C8H12N2O2S
Molecular Weight:
200.2581
MDL Number:
MFCD06212900
IUPAC Name:
N-[4-(aminomethyl)phenyl]methanesulfonamide
InChI:
InChI=1S/C8H12N2O2S/c1-13(11,12)10-8-4-2-7(6-9)3-5-8/h2-5,10H,6,9H2,1H3
InChI Key:
IZJVPNBRAKIMBK-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)NS(=O)(=O)C
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.062g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.256g/mol
Monoisotopic Mass:
200.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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