787631-63-4
2'-METHYL-5'-NITRO-[1,1'-BIPHENYL]-2-CARBOXYLIC ACID
Name2'-METHYL-5'-NITRO-[1,1'-BIPHENYL]-2-CARBOXYLIC ACID
1Identification
【Name】
2'-METHYL-5'-NITRO-[1,1'-BIPHENYL]-2-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD11932195
【English Synonyms】
【Formula】
C14 H11 N O4
【MolWeight】
257.244
【Inchi】
InChI=1S/C14H11NO4/c1-9-6-7-10(15(18)19)8-13(9)11-4-2-3-5-12(11)14(16)17/h2-8H,1H3,(H,16,17)
【InChIKey】
InChIKey=JSFMTXCXVBYKGF-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1c2ccccc2C(=O)O)[N+](=O)[O-]
【MOL File】
2'-METHYL-5'-NITRO-[….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2'-METHYL-5'-NITRO-[1,1'-BIPHENYL]-2-CARBOXYLIC ACID.cml