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13162-24-8

13162-24-8 | 2-Pyrimidinamine, 4-chloro-6-methyl-5-nitro-

CAS No: 13162-24-8 Catalog No: AG000ZJ3 MDL No:MFCD09999219

Product Description

Catalog Number:
AG000ZJ3
Chemical Name:
2-Pyrimidinamine, 4-chloro-6-methyl-5-nitro-
CAS Number:
13162-24-8
Molecular Formula:
C5H5ClN4O2
Molecular Weight:
188.5718
MDL Number:
MFCD09999219
IUPAC Name:
4-chloro-6-methyl-5-nitropyrimidin-2-amine
InChI:
InChI=1S/C5H5ClN4O2/c1-2-3(10(11)12)4(6)9-5(7)8-2/h1H3,(H2,7,8,9)
InChI Key:
GZVHDXMPPJYNJK-UHFFFAOYSA-N
SMILES:
Nc1nc(C)c(c(n1)Cl)[N+](=O)[O-]
NSC Number:
73543

Properties

Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.01g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.571g/mol
Monoisotopic Mass:
188.01g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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