860562-73-8
BENZOIC ACID, P-ALPHA-METHYLISOBUTYL-
NameBENZOIC ACID, P-ALPHA-METHYLISOBUTYL-
1Identification
【Name】
BENZOIC ACID, P-ALPHA-METHYLISOBUTYL-
【CAS】
【MDL】
MFCD17015315
【English Synonyms】
【Formula】
C12 H16 O2
【MolWeight】
192.256
【Inchi】
InChI=1S/C12H16O2/c1-8(2)9(3)10-4-6-11(7-5-10)12(13)14/h4-9H,1-3H3,(H,13,14)
【InChIKey】
InChIKey=DOZKMNAYSIGVBZ-UHFFFAOYSA-N
【SMILES】
CC(C)C(C)c1ccc(cc1)C(=O)O
【MOL File】
BENZOIC ACID, P-ALPH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BENZOIC ACID, P-ALPHA-METHYLISOBUTYL-.cml