Benzenepropanoic  acid,a-hydroxy-b-methoxy-b-phenyl-,(aS)- Structure

Benzenepropanoic acid,a-hydroxy-b-methoxy-b-phenyl-,(aS)-

Chemical Properties

Melting point 121 °C
Boiling point 430.3±45.0 °C(Predicted)
Density  1.248
storage temp.  Sealed in dry,Room Temperature
solubility  DMSO (Slightly), Ethanol (Sparingly, Sonicated), Methanol (Slightly)
pka 3.24±0.28(Predicted)
form  Solid
color  White to Off-White
InChI InChI=1/C16H16O4/c1-20-16(14(17)15(18)19,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,14,17H,1H3,(H,18,19)/t14-/s3
InChIKey RQJWOLFMWKZKCJ-WDHUHKLTNA-N
SMILES C(OC)(C1=CC=CC=C1)(C1C=CC=CC=1)[C@H](O)C(=O)O |&1:15,r|
FDA UNII BYC8HKB4JS

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H319-H315
Precautionary statements P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
HS Code  2918.99.4700
NFPA 704:
0
2 0

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Benzenepropanoic acid,a-hydroxy-b-methoxy-b-phenyl-,(aS)- Spectrum