69829-46-5
7-HYDROXY-2,2-DIPHENYL-BENZO(1,3)DIOXOLE-5-CARBOXYLIC ACID METHYL ESTER
Name7-HYDROXY-2,2-DIPHENYL-BENZO(1,3)DIOXOLE-5-CARBOXYLIC ACID METHYL ESTER
1Identification
【Name】
7-HYDROXY-2,2-DIPHENYL-BENZO(1,3)DIOXOLE-5-CARBOXYLIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD00183275
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C21 H16 O5
【pro_molWeight】
348.352
【Inchi】
InChI=1S/C21H16O5/c1-24-20(23)14-12-17(22)19-18(13-14)25-21(26-19,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,22H,1H3
【InChIKey】
InChIKey=WAUGRGIYXIPCRC-UHFFFAOYSA-N
【SMILES】
COC(=O)c1cc(c2c(c1)OC(O2)(c3ccccc3)c4ccccc4)O
【MOL File】
7-HYDROXY-2,2-DIPHEN….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:5
XLogP3:6.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
7-HYDROXY-2,2-DIPHENYL-BENZO(1,3)DIOXOLE-5-CARBOXYLIC ACID METHYL ESTER.cml