3-METHYL-2-PHENYLVALERIC ACID

CAS No.
7782-37-8
CCD No.
CCD00004076
Formula
C12 H16 O2
MolWeight
192.256

Basic Information

Product Name: 3-METHYL-2-PHENYLVALERIC ACID
CAS: 7782-37-8
English Synonyms: 3-METHYL-2-PHENYLVALERIC ACID ; 3-METHYL-2-PHENYLPENTANOIC ACID
MDL Number.: MFCD00004254
H bond acceptor: 2
H bond donor: 1
Smile: CCC(C)C(c1ccccc1)C(=O)O
InChi: InChI=1S/C12H16O2/c1-3-9(2)11(12(13)14)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3,(H,13,14)
InChiKey: InChIKey=NQVALZRLGIRTKX-UHFFFAOYSA-N

Property

Melting Point: 50-52 DEG C(LIT)
Physical Property: FLASHPOINT: 113 DEG C
FLASHPOINT: 235.4 DEG F
Comments: UNSPSC: 12352100
WGK: 3
Information: MIXTURE OF ERYTHRO AND THREO

Safety information

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