267881-57-2
8-BROMO-4-HYDROXY-5-(1-METHYLETHOXY)-2-NAPHTHALENECARBOXYLIC ACID METHYL ESTER
Name8-BROMO-4-HYDROXY-5-(1-METHYLETHOXY)-2-NAPHTHALENECARBOXYLIC ACID METHYL ESTER
1Identification
【Name】
8-BROMO-4-HYDROXY-5-(1-METHYLETHOXY)-2-NAPHTHALENECARBOXYLIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD13181292
【English Synonyms】
【Formula】
C15 H15 Br O4
【MolWeight】
339.184
【Inchi】
InChI=1S/C15H15BrO4/c1-8(2)20-13-5-4-11(16)10-6-9(15(18)19-3)7-12(17)14(10)13/h4-8,17H,1-3H3
【InChIKey】
InChIKey=LIWNETMLJBSSBB-UHFFFAOYSA-N
【SMILES】
CC(C)Oc1ccc(c2c1c(cc(c2)C(=O)OC)O)Br
【MOL File】
8-BROMO-4-HYDROXY-5-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
8-BROMO-4-HYDROXY-5-(1-METHYLETHOXY)-2-NAPHTHALENECARBOXYLIC ACID METHYL ESTER.cml