4-PHENYLBUTYRIC ACID

CAS No.
1821-12-1 ;1716-12-7
CCD No.
CCD00004225
Formula
C10 H12 O2
MolWeight
164.203

Basic Information

Product Name: 4-PHENYLBUTYRIC ACID
CAS: 1821-12-1 ;1716-12-7
English Synonyms: BENZENEBUTANOIC ACID ; PHENYLBUTYRIC-4 ACID ; 4-PHENYL-N-BUTYRIC ACID ; 4-PHENYBUTYTIC ACID ; PHENYLBUTYRATE ; 4-BENZENEBUTYRIC ACID ; PHENYLBUTYRIC ACID ; GAMA-PHENYLBUTYRIC ACID ; 4-PHENYLBUTANOIC ACID ; 4-PHENYLBUTYRIC ACID ; SODIUM PHENYLBUTYRATE
MDL Number.: MFCD00004403
H bond acceptor: 2
H bond donor: 1
Smile: c1ccc(cc1)CCCC(=O)O
InChi: InChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)
InChiKey: InChIKey=OBKXEAXTFZPCHS-UHFFFAOYSA-N

Property

Melting Point: 49-51 DEG C(LIT)
Boiling Point: 165 DEG C/10 MMHG(LIT)
Physical Property: FLASHPOINT: >113 DEG C
FLASHPOINT: >235.4 DEG F
Comments: UNSPSC: 12352100
WGK: 3

Safety information

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