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alpha-Amyrin Structure

alpha-Amyrin

  • Product Namealpha-Amyrin
  • CAS638-95-9
  • CBNumberCB9767508
  • MFC30H50O
  • MW426.73
  • EINECS211-352-1
  • MDL NumberMFCD00016754
  • MOL File638-95-9.mol

Chemical Properties

Melting point: 178-183°C
alpha  D17 +91.6° (c = 1.3 in benzene)
Boiling point: bp0.7 243°
Density  0.9600 (rough estimate)
refractive index  1.4910 (estimate)
solubility  DMSO (Slightly), Methanol (Slightly, Sonicated)
pka 15.18±0.70(Predicted)
form  Solid
color  White to off-white
optical activity +93.3 (c 5.55, C6H6)
BRN  1916550
Major Application food and beverages
Cosmetics Ingredients Functions SKIN PROTECTING
SKIN CONDITIONING - MISCELLANEOUS
InChIKey FSLPMRQHCOLESF-SFMCKYFRSA-N
SMILES C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C
LogP 10.636 (est)
CAS DataBase Reference 638-95-9(CAS DataBase Reference)
NIST Chemistry Reference «ALPHA»-amyrin(638-95-9)
EPA Substance Registry System Urs-12-en-3-ol, (3.beta.)- (638-95-9)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H302
Precautionary statements  P264-P270-P301+P312-P501
PPE Eyeshields, Gloves, type N95 (US)
Hazard Codes  Xi
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

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