546072-02-0
N-(2-METHYL-4-NITROPHENYL)-PYRAZINECARBOXAMIDE
NameN-(2-METHYL-4-NITROPHENYL)-PYRAZINECARBOXAMIDE
1Identification
【Name】
N-(2-METHYL-4-NITROPHENYL)-PYRAZINECARBOXAMIDE
【CAS】
【MDL】
MFCD03393108
【English Synonyms】
【Formula】
C12 H10 N4 O3
【MolWeight】
258.236
【Inchi】
InChI=1S/C12H10N4O3/c1-8-6-9(16(18)19)2-3-10(8)15-12(17)11-7-13-4-5-14-11/h2-7H,1H3,(H,15,17)
【InChIKey】
InChIKey=SAOSWMUQIUDZNY-UHFFFAOYSA-N
【SMILES】
Cc1cc(ccc1NC(=O)c2cnccn2)[N+](=O)[O-]
【MOL File】
N-(2-METHYL-4-NITROP….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(2-METHYL-4-NITROPHENYL)-PYRAZINECARBOXAMIDE.cml