56617-42-6
4-[(2,4-DIMETHYLPHENYL)METHOXY]-BENZOIC ACID
Name4-[(2,4-DIMETHYLPHENYL)METHOXY]-BENZOIC ACID
1Identification
【Name】
4-[(2,4-DIMETHYLPHENYL)METHOXY]-BENZOIC ACID
【CAS】
【MDL】
MFCD17171046
【English Synonyms】
【Formula】
C16 H16 O3
【MolWeight】
256.299
【Inchi】
InChI=1S/C16H16O3/c1-11-3-4-14(12(2)9-11)10-19-15-7-5-13(6-8-15)16(17)18/h3-9H,10H2,1-2H3,(H,17,18)
【InChIKey】
InChIKey=TZYFOIBCPQUESF-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c(c1)C)COc2ccc(cc2)C(=O)O
【MOL File】
4-[(2,4-DIMETHYLPHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[(2,4-DIMETHYLPHENYL)METHOXY]-BENZOIC ACID.cml