828-01-3

Name DL-BETA-PHENYLLACTIC ACID
CAS 828-01-3
EINECS(EC#) 212-580-4
Molecular Formula C9H10O3
MDL Number MFCD00065928
Molecular Weight 166.17
MOL File 828-01-3.mol
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Chemical Properties

Appearance Off-white crystalline powder
Melting point  95-98 °C
Boiling point  254.38°C (rough estimate)
density  1.265
refractive index  1.5286 (estimate)
storage temp.  2-8°C
solubility  Acetonitrile (Slightly), DMSO (Slightly)
form  Crystalline Powder
pka 3.72±0.10(Predicted)
color  Off-white
BRN  2209791
InChI 1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)
InChIKey VOXXWSYKYCBWHO-UHFFFAOYSA-N
SMILES OC(Cc1ccccc1)C(O)=O
LogP 0.250 (est)
CAS DataBase Reference 828-01-3(CAS DataBase Reference)
EPA Substance Registry System 3-Phenyllactic acid (828-01-3)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H319
Precautionary statements  P305+P351+P338
Safety Statements 
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
WGK Germany  3
TSCA  Yes
HS Code  29181990
Storage Class 11 - Combustible Solids

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