153733-74-5
2-METHYL-4-PHENYL-1-INDANONE
Name2-METHYL-4-PHENYL-1-INDANONE
1Identification
【Name】
2-METHYL-4-PHENYL-1-INDANONE
【CAS】
【MDL】
MFCD00799564
【English Synonyms】
【Formula】
C16 H14 O
【MolWeight】
222.286
【Inchi】
InChI=1S/C16H14O/c1-11-10-15-13(12-6-3-2-4-7-12)8-5-9-14(15)16(11)17/h2-9,11H,10H2,1H3
【InChIKey】
InChIKey=IVYCZGYSZDAEPE-UHFFFAOYSA-N
【SMILES】
CC1Cc2c(cccc2C1=O)c3ccccc3
【MOL File】
2-METHYL-4-PHENYL-1-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:4.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-METHYL-4-PHENYL-1-INDANONE.cml