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DL-BETA-PHENYLLACTIC ACID

CAS
828-01-3
Catalog Number
ACM828013
Category
Other Products
Molecular Weight
166.18
Molecular Formula
C9H10O3

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Specification

Synonyms
(n)-3-Phenyllactic acid
IUPAC Name
2-Hydroxy-3-phenylpropanoic acid
Canonical SMILES
C1=CC=C(C=C1)CC(C(=O)O)O
InChI
InChI=1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)
InChI Key
VOXXWSYKYCBWHO-UHFFFAOYSA-N
Boiling Point
254.38 °C
Melting Point
95-98 °C
Density
1.265 g/cm³
Appearance
Off-white crystalline powder
Storage
2-8 °C
Complexity
150
Exact Mass
166.062994177
Monoisotopic Mass
166.062994177
pKa
3.72±0.10(Predicted)
Refractive Index
1.5286
Topological Polar Surface Area
57.5 Ų
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