828932-94-1
4-HYDROXY-5,6,8-TRIMETHOXY-2-NAPHTHALENECARBOXYLIC ACID METHYL ESTER
Name4-HYDROXY-5,6,8-TRIMETHOXY-2-NAPHTHALENECARBOXYLIC ACID METHYL ESTER
1Identification
【Name】
4-HYDROXY-5,6,8-TRIMETHOXY-2-NAPHTHALENECARBOXYLIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD13181261
【English Synonyms】
【Formula】
C15 H16 O6
【MolWeight】
292.285
【Inchi】
InChI=1S/C15H16O6/c1-18-11-7-12(19-2)14(20-3)13-9(11)5-8(6-10(13)16)15(17)21-4/h5-7,16H,1-4H3
【InChIKey】
InChIKey=IZSXXHXGMAHJPH-UHFFFAOYSA-N
【SMILES】
COc1cc(c(c2c1cc(cc2O)C(=O)OC)OC)OC
【MOL File】
4-HYDROXY-5,6,8-TRIM….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-HYDROXY-5,6,8-TRIMETHOXY-2-NAPHTHALENECARBOXYLIC ACID METHYL ESTER.cml