41205-45-2
ALPHA-ALLYL-ALPHA-(O-CARBOMETHOXY)PHENYL-GAMMA-METHYL-GAMMA-BUTYROLACTONE
NameALPHA-ALLYL-ALPHA-(O-CARBOMETHOXY)PHENYL-GAMMA-METHYL-GAMMA-BUTYROLACTONE
1Identification
【Name】
ALPHA-ALLYL-ALPHA-(O-CARBOMETHOXY)PHENYL-GAMMA-METHYL-GAMMA-BUTYROLACTONE
【CAS】
【MDL】
MFCD01660140
【English Synonyms】
【Formula】
C16 H18 O4
【MolWeight】
274.314
【Inchi】
InChI=1S/C16H18O4/c1-4-9-16(10-11(2)20-15(16)18)13-8-6-5-7-12(13)14(17)19-3/h4-8,11H,1,9-10H2,2-3H3
【InChIKey】
InChIKey=QUHMHLIMGCIDSZ-UHFFFAOYSA-N
【SMILES】
CC1CC(C(=O)O1)(CC=C)c2ccccc2C(=O)OC
【MOL File】
ALPHA-ALLYL-ALPHA-(O….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ALPHA-ALLYL-ALPHA-(O-CARBOMETHOXY)PHENYL-GAMMA-METHYL-GAMMA-BUTYROLACTONE.cml