1501-05-9
4-BENZOYLBUTYRIC ACID
Name
4-BENZOYLBUTYRIC ACID
Formula
C11 H12 O3
MolWeight
192.213
1Identification
【Name】
4-BENZOYLBUTYRIC ACID
【CAS】
【MDL】
MFCD00004411
【English Synonyms】
【Formula】
C11 H12 O3
【MolWeight】
192.213
【Inchi】
InChI=1S/C11H12O3/c12-10(7-4-8-11(13)14)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,13,14)
【InChIKey】
InChIKey=SHKWSBAVRQZYLE-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)C(=O)CCCC(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
ALFA AESAR, AVOCADO, LANCASTER :4-BENZOYLBUTYRIC ACID
Acros Organics :4-BENZOYLBUTYRIC ACID
TCI (Shanghai) Development Co., Ltd. :4-BENZOYLBUTYRIC ACID
【Safety informationSymbol】
【Signal word】
【Hazard statements】
【Precautionary statements】
【hazard symbol】
【Risk Code】
【Safe Code】
【WGK Germany】
3
4CML File
4-BENZOYLBUTYRIC ACID.cml
Quick Release
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