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4094-00-2 | N-methyl-5-nitro-pyrimidine-4,6-diamine
CAS No: 4094-00-2 Catalog No: AG01FMA8 MDL No:
Product Description
Catalog Number:
AG01FMA8
Chemical Name:
N-methyl-5-nitro-pyrimidine-4,6-diamine
CAS Number:
4094-00-2
IUPAC Name:
4-N-methyl-5-nitropyrimidine-4,6-diamine
InChI:
InChI=1S/C5H7N5O2/c1-7-5-3(10(11)12)4(6)8-2-9-5/h2H,1H3,(H3,6,7,8,9)
InChI Key:
GEMCWVNKCZNIML-UHFFFAOYSA-N
NSC Number:
401240
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.06g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
169.144g/mol
Monoisotopic Mass:
169.06g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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