109543-76-2
2-[[2-(4-CHLOROPHENYL)-4-METHYLOXAZOL-5-YL]METHOXY]-2-METHYLPROPANOIC ACID
Name2-[[2-(4-CHLOROPHENYL)-4-METHYLOXAZOL-5-YL]METHOXY]-2-METHYLPROPANOIC ACID
1Identification
【Name】
2-[[2-(4-CHLOROPHENYL)-4-METHYLOXAZOL-5-YL]METHOXY]-2-METHYLPROPANOIC ACID
【CAS】
【MDL】
MFCD00878626
【English Synonyms】
【Formula】
C15 H16 Cl N O4
【MolWeight】
309.747
【Inchi】
InChI=1S/C15H16ClNO4/c1-9-12(8-20-15(2,3)14(18)19)21-13(17-9)10-4-6-11(16)7-5-10/h4-7H,8H2,1-3H3,(H,18,19)
【InChIKey】
InChIKey=LNXXSBRGLBOASF-UHFFFAOYSA-N
【SMILES】
Cc1c(oc(n1)c2ccc(cc2)Cl)COC(C)(C)C(=O)O
【MOL File】
2-[[2-(4-CHLOROPHENY….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-[[2-(4-CHLOROPHENYL)-4-METHYLOXAZOL-5-YL]METHOXY]-2-METHYLPROPANOIC ACID.cml