Home Nitros 1H-Imidazol-5-amine,1-methyl-4-nitro-(9CI)

1H-Imidazol-5-amine,1-methyl-4-nitro-(9CI)

CAS No.:
4531-54-8
Catalog Number:
AG00DJFT
Molecular Formula:
C4H6N4O2
Molecular Weight:
142.1160
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Product Description
Catalog Number:
AG00DJFT
Chemical Name:
1H-Imidazol-5-amine,1-methyl-4-nitro-(9CI)
CAS Number:
4531-54-8
Molecular Formula:
C4H6N4O2
Molecular Weight:
142.1160
MDL Number:
MFCD00516996
IUPAC Name:
3-methyl-5-nitroimidazol-4-amine
InChI:
InChI=1S/C4H6N4O2/c1-7-2-6-4(3(7)5)8(9)10/h2H,5H2,1H3
InChI Key:
GJVMTMXQJDQJSS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ncn(c1N)C
UNII:
55UIE6811G
NSC Number:
400013
Properties
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.049g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
142.118g/mol
Monoisotopic Mass:
142.049g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
89.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties