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121816-80-6

121816-80-6 | 1H-Imidazole-1-sulfonamide, N,N-dimethyl-2-nitro-

CAS No: 121816-80-6 Catalog No: AG00162C MDL No:MFCD23135683

Product Description

Catalog Number:
AG00162C
Chemical Name:
1H-Imidazole-1-sulfonamide, N,N-dimethyl-2-nitro-
CAS Number:
121816-80-6
Molecular Formula:
C5H8N4O4S
Molecular Weight:
220.2064
MDL Number:
MFCD23135683
IUPAC Name:
N,N-dimethyl-2-nitroimidazole-1-sulfonamide
InChI:
InChI=1S/C5H8N4O4S/c1-7(2)14(12,13)8-4-3-6-5(8)9(10)11/h3-4H,1-2H3
InChI Key:
IKIRODUWLINOTO-UHFFFAOYSA-N
SMILES:
CN(S(=O)(=O)n1ccnc1[N+](=O)[O-])C

Properties

Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.027g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.203g/mol
Monoisotopic Mass:
220.027g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  

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