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Sclareol Structure

Sclareol

  • Product NameSclareol
  • CAS515-03-7
  • CBNumberCB2173575
  • MFC20H36O2
  • MW308.51
  • EINECS208-194-0
  • MDL NumberMFCD00869558
  • MOL File515-03-7.mol

Chemical Properties

Melting point: 95-100 °C (lit.)
Boiling point: 218-220 °C/19 mmHg (lit.)
alpha  -13 º (c=4, in carbon tetrachloride)
Density  0.954±0.06 g/cm3(Predicted)
FEMA  4502 | (-)-SCLAREOL
storage temp.  2-8°C
solubility  Chlorform, Ethyl Acetate (Slightly)
pka 14.49±0.29(Predicted)
form  Solid
color  White to Off-White
Odor at 100.00 %. sweet balsam clary amber woody weedy
Odor Type balsamic
biological source Salvia sclarea L
optical activity [α]25/D 13°, c = 4 in carbon tetrachloride
JECFA Number 2029
BRN  2054148
Major Application cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C20H36O2/c1-7-18(4,21)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)22/h7,15-16,21-22H,1,8-14H2,2-6H3/t15-,16+,18-,19-,20+/m0/s1
InChIKey XVULBTBTFGYVRC-HHUCQEJWSA-N
SMILES CC1(C)CCC[C@@]2(C)[C@H]1CC[C@@](C)(O)[C@@H]2CC[C@@](C)(O)C=C
LogP 5.54
CAS DataBase Reference 515-03-7(CAS DataBase Reference)
NIST Chemistry Reference 1-Naphthalenepropanol, «alpha»-ethenyldecahydro-2-hydroxy-«alpha»,2,5,5,8a-pentamethyl-, [1r-[1«alpha»(r*),2«beta»,4a«beta»,8a«alpha»]]-(515-03-7)
EPA Substance Registry System Sclareol (515-03-7)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H319
Precautionary statements  P264-P280-P337+P313-P305+P351+P338
WGK Germany  2
RTECS  QK0301900
TSCA  TSCA listed
HS Code  2906199090
Storage Class 11 - Combustible Solids
REACH Registrations Active

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Sclareol Chemical Properties,Usage,Production

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