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67639-97-8 | 1H-Imidazole, 2,3-dihydro-1,3-dimethyl-4-nitro-
CAS No: 67639-97-8 Catalog No: AG00649H MDL No:
Product Description
Catalog Number:
AG00649H
Chemical Name:
1H-Imidazole, 2,3-dihydro-1,3-dimethyl-4-nitro-
CAS Number:
67639-97-8
Molecular Formula:
C5H9N3O2
Molecular Weight:
143.1439
IUPAC Name:
1,3-dimethyl-4-nitro-2H-imidazole
InChI:
InChI=1S/C5H9N3O2/c1-6-3-5(8(9)10)7(2)4-6/h3H,4H2,1-2H3
InChI Key:
PUORUUWJNOYQFK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C1=CN(CN1C)C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.069g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.146g/mol
Monoisotopic Mass:
143.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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