Home Sulfos N-[(3-amino-4-methoxyphenyl)methyl]methanesulfonamide

N-[(3-amino-4-methoxyphenyl)methyl]methanesulfonamide

CAS No.:
54179-16-7
Catalog Number:
AG01AUMD
Molecular Formula:
C9H14N2O3S
Molecular Weight:
230.2841
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Product Description
Catalog Number:
AG01AUMD
Chemical Name:
N-[(3-amino-4-methoxyphenyl)methyl]methanesulfonamide
CAS Number:
54179-16-7
Molecular Formula:
C9H14N2O3S
Molecular Weight:
230.2841
MDL Number:
MFCD12772958
IUPAC Name:
N-[(3-amino-4-methoxyphenyl)methyl]methanesulfonamide
InChI:
InChI=1S/C9H14N2O3S/c1-14-9-4-3-7(5-8(9)10)6-11-15(2,12)13/h3-5,11H,6,10H2,1-2H3
InChI Key:
FREZFOWNGXNPKT-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1N)CNS(=O)(=O)C
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.073g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
230.282g/mol
Monoisotopic Mass:
230.073g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
89.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties