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189814-61-7

189814-61-7 | Benzenesulfonamide, 3-(2-azido-1-hydroxyethyl)-4-methyl-

CAS No: 189814-61-7 Catalog No: AG002E0K MDL No:

Product Description

Catalog Number:
AG002E0K
Chemical Name:
Benzenesulfonamide, 3-(2-azido-1-hydroxyethyl)-4-methyl-
CAS Number:
189814-61-7
Molecular Formula:
C9H12N4O3S
Molecular Weight:
256.2816
IUPAC Name:
3-(2-azido-1-hydroxyethyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C9H12N4O3S/c1-6-2-3-7(17(11,15)16)4-8(6)9(14)5-12-13-10/h2-4,9,14H,5H2,1H3,(H2,11,15,16)
InChI Key:
OWWLVLPVNGJVMX-UHFFFAOYSA-N
SMILES:
OC(c1cc(ccc1C)S(=O)(=O)N)CN=[N+]=[N-]

Properties

Complexity:
399  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.063g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
256.28g/mol
Monoisotopic Mass:
256.063g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

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