Home Other Building Blocks 2-AMINO-4-CYANOBENZENE-1-SULFONAMIDE

2-AMINO-4-CYANOBENZENE-1-SULFONAMIDE

CAS No.:
1161945-87-4
Catalog Number:
AG01B35Q
Molecular Formula:
C7H7N3O2S
Molecular Weight:
197.2144
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Product Description
Catalog Number:
AG01B35Q
Chemical Name:
2-AMINO-4-CYANOBENZENE-1-SULFONAMIDE
CAS Number:
1161945-87-4
Molecular Formula:
C7H7N3O2S
Molecular Weight:
197.2144
MDL Number:
MFCD20436864
IUPAC Name:
2-amino-4-cyanobenzenesulfonamide
InChI:
InChI=1S/C7H7N3O2S/c8-4-5-1-2-7(6(9)3-5)13(10,11)12/h1-3H,9H2,(H2,10,11,12)
InChI Key:
MIRLMGWYXXOHNG-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)N)S(=O)(=O)N
Properties
Complexity:
323  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.026g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.212g/mol
Monoisotopic Mass:
197.026g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties