Mandelic acid Structure

Mandelic acid

Chemical Properties

Melting point 131-133 °C(lit.)
Boiling point 214.6°C (rough estimate)
alpha  -150 º (c=2.5, H2O)
Density  1.1677 (rough estimate)
bulk density 670kg/m3
refractive index  -153.5 ° (C=1, H2O)
Flash point >190℃
storage temp.  Store below +30°C.
solubility  109.8g/l soluble
form  Crystalline Powder, Crystals or Flakes
pka 3.37(at 25℃)
color  White to slightly yellow-beige
PH 3.34(1 mM solution);2.75(10 mM solution);2.22(100 mM solution);
optical activity [α]25/D 151°, c = 1 in ethanol
Water Solubility  It is partly soluble in water, freely soluble in isopropyl and ethyl alcohol.
Sensitive  Light Sensitive
BRN  2691094
Stability Stable, but light sensitive. Combustible. Incompatible with strong bases, strong oxidizing agents.
InChI 1S/C8H8O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7,9H,(H,10,11)/t7-/m1/s1
InChIKey IWYDHOAUDWTVEP-SSDOTTSWSA-N
SMILES O[C@@H](C(O)=O)c1ccccc1
LogP 0.550 (est)
CAS DataBase Reference 611-71-2(CAS DataBase Reference)
FDA UNII PPL7YW1M9W
ATC code B05CA06,J01XX06
EPA Substance Registry System Benzeneacetic acid, .alpha.-hydroxy-, (.alpha.R)- (611-71-2)
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordDanger
Hazard statements H318
Precautionary statements P280-P305+P351+P338
Hazard Codes  Xi
Risk Statements  41-36/37/38
Safety Statements  22-24/25-36-26-39-37/39
WGK Germany  1
Hazard Note  Irritant/Light Sensitive
TSCA  TSCA listed
HS Code  29181980
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Dam. 1
Toxicity LD50 orally in Rabbit: 5000 mg/kg
NFPA 704:
1
2 0

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