646530-39-4
4-(5-METHYL-1,2-OXAZOLE-3-AMIDO)BENZOIC ACID
Name4-(5-METHYL-1,2-OXAZOLE-3-AMIDO)BENZOIC ACID
1Identification
【Name】
4-(5-METHYL-1,2-OXAZOLE-3-AMIDO)BENZOIC ACID
【CAS】
【MDL】
MFCD11538024
【English Synonyms】
【Formula】
C12 H10 N2 O4
【MolWeight】
246.221
【Inchi】
InChI=1S/C12H10N2O4/c1-7-6-10(14-18-7)11(15)13-9-4-2-8(3-5-9)12(16)17/h2-6H,1H3,(H,13,15)(H,16,17)
【InChIKey】
InChIKey=LOPGZTFZOUEXLZ-UHFFFAOYSA-N
【SMILES】
Cc1cc(no1)C(=O)Nc2ccc(cc2)C(=O)O
【MOL File】
4-(5-METHYL-1,2-OXAZ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(5-METHYL-1,2-OXAZOLE-3-AMIDO)BENZOIC ACID.cml