732252-30-1
CIS-3-(4-METHOXYBENZOYL)CYCLOPENTANE-1-CARBOXYLIC ACID
Name
CIS-3-(4-METHOXYBENZOYL)CYCLOPENTANE-1-CARBOXYLIC ACID
Formula
C14 H16 O4
MolWeight
248.276
1Identification
【Name】
CIS-3-(4-METHOXYBENZOYL)CYCLOPENTANE-1-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD01311201
【English Synonyms】
【Formula】
C14 H16 O4
【MolWeight】
248.276
【Inchi】
InChI=1S/C14H16O4/c1-18-12-6-4-9(5-7-12)13(15)10-2-3-11(8-10)14(16)17/h4-7,10-11H,2-3,8H2,1H3,(H,16,17)/t10-,11+/m0/s1
【InChIKey】
InChIKey=WKGLTBFKXDKKGA-WDEREUQCSA-N
【SMILES】
COc1ccc(cc1)C(=O)[C@H]2CC[C@H](C2)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CIS-3-(4-METHOXYBENZOYL)CYCLOPENTANE-1-CARBOXYLIC ACID.cml
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