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1248819-21-7 | 1,2-Benzenediamine, N1-cyclopropyl-4-nitro-
CAS No: 1248819-21-7 Catalog No: AG000MU2 MDL No:MFCD16665088
Product Description
Catalog Number:
AG000MU2
Chemical Name:
1,2-Benzenediamine, N1-cyclopropyl-4-nitro-
CAS Number:
1248819-21-7
Molecular Formula:
C9H11N3O2
Molecular Weight:
193.2025
MDL Number:
MFCD16665088
IUPAC Name:
1-N-cyclopropyl-4-nitrobenzene-1,2-diamine
InChI:
InChI=1S/C9H11N3O2/c10-8-5-7(12(13)14)3-4-9(8)11-6-1-2-6/h3-6,11H,1-2,10H2
InChI Key:
PHCMNECVJVGQIF-UHFFFAOYSA-N
SMILES:
Nc1cc(ccc1NC1CC1)[N+](=O)[O-]
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.206g/mol
Monoisotopic Mass:
193.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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