784140-92-7
1-(2',3'-DICHLORO[1,1'-BIPHENYL]-3-YL)-5-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
Name1-(2',3'-DICHLORO[1,1'-BIPHENYL]-3-YL)-5-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
1Identification
【Name】
1-(2',3'-DICHLORO[1,1'-BIPHENYL]-3-YL)-5-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD13195193
【English Synonyms】
【Formula】
C17 H12 Cl2 N2 O2
【MolWeight】
347.2
【Inchi】
InChI=1S/C17H12Cl2N2O2/c1-10-8-15(17(22)23)20-21(10)12-5-2-4-11(9-12)13-6-3-7-14(18)16(13)19/h2-9H,1H3,(H,22,23)
【InChIKey】
InChIKey=UXTQFMLRGPMZRO-UHFFFAOYSA-N
【SMILES】
Cc1cc(nn1c2cccc(c2)c3cccc(c3Cl)Cl)C(=O)O
【MOL File】
1-(2',3'-DICHLORO[1,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2',3'-DICHLORO[1,1'-BIPHENYL]-3-YL)-5-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID.cml