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14080-34-3

14080-34-3 | Pyrimidine, 2-methyl-5-nitro-

CAS No: 14080-34-3 Catalog No: AG001CST MDL No:MFCD00234086

Product Description

Catalog Number:
AG001CST
Chemical Name:
Pyrimidine, 2-methyl-5-nitro-
CAS Number:
14080-34-3
Molecular Formula:
C5H5N3O2
Molecular Weight:
139.1121
MDL Number:
MFCD00234086
IUPAC Name:
2-methyl-5-nitropyrimidine
InChI:
InChI=1S/C5H5N3O2/c1-4-6-2-5(3-7-4)8(9)10/h2-3H,1H3
InChI Key:
NLGWYOYUTYUEQT-UHFFFAOYSA-N
SMILES:
Cc1ncc(cn1)[N+](=O)[O-]

Properties

Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.038g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
139.114g/mol
Monoisotopic Mass:
139.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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