75024-23-6
1-(3-METHYLPHENYL)CYCLOPENTANE-1-CARBOXYLIC ACID
Name1-(3-METHYLPHENYL)CYCLOPENTANE-1-CARBOXYLIC ACID
1Identification
【Name】
1-(3-METHYLPHENYL)CYCLOPENTANE-1-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD00019293
【English Synonyms】
【Formula】
C13 H16 O2
【MolWeight】
204.267
【Inchi】
InChI=1S/C13H16O2/c1-10-5-4-6-11(9-10)13(12(14)15)7-2-3-8-13/h4-6,9H,2-3,7-8H2,1H3,(H,14,15)
【InChIKey】
InChIKey=VHDMREIZSHJHMB-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1)C2(CCCC2)C(=O)O
【MOL File】
1-(3-METHYLPHENYL)CY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(3-METHYLPHENYL)CYCLOPENTANE-1-CARBOXYLIC ACID.cml