856847-48-8
1(6H)-PYRIDAZINEACETIC ACID, 3-METHYL-6-OXO-ALPHA-PHENYL-
Name1(6H)-PYRIDAZINEACETIC ACID, 3-METHYL-6-OXO-ALPHA-PHENYL-
1Identification
【Name】
1(6H)-PYRIDAZINEACETIC ACID, 3-METHYL-6-OXO-ALPHA-PHENYL-
【CAS】
【MDL】
MFCD17018074
【English Synonyms】
【Formula】
C13 H12 N2 O3
【MolWeight】
244.249
【Inchi】
InChI=1S/C13H12N2O3/c1-9-7-8-11(16)15(14-9)12(13(17)18)10-5-3-2-4-6-10/h2-8,12H,1H3,(H,17,18)
【InChIKey】
InChIKey=NVXVPPCSAHUEDQ-UHFFFAOYSA-N
【SMILES】
Cc1ccc(=O)n(n1)C(c2ccccc2)C(=O)O
【MOL File】
1(6H)-PYRIDAZINEACET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1(6H)-PYRIDAZINEACETIC ACID, 3-METHYL-6-OXO-ALPHA-PHENYL-.cml