Sclareol

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Names

[ CAS No. ]:
515-03-7

[ Name ]:
Sclareol

[Synonym ]:
(1R,2R,4aS,8aS)-1-[(3R)-3-Hydroxy-3-methyl-4-penten-1-yl]-2,5,5,8a-tetramethyldecahydro-2-naphthalenol
(1R,2R,4aS,8aS)-1-[(3R)-3-Hydroxy-3-methylpent-4-en-1-yl]-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol
SCLAREOL(RG)
EINECS 208-194-0
1-Naphthalenepropanol, α-ethenyldecahydro-2-hydroxy-α,2,5,5,8a-pentamethyl-, (αR,1R,2R,4aS,8aS)-
Labd-14-ene-8,13-diol, (13R)-
SCIADONIC ACID
(1R,2R,8aS)-Decahydro-1-(3-hydroxy-3-methyl-4-pentenyl)-2,5,5,8a-tetramethyl-2-naphthol
labd-14-ene-8,13(R)-diol
MFCD00869558
SCLAREOL,NATURAL
SCAREOL
Sclareol
(-)-sclareol
SCLAREOL(P)
(1R,2R,4aS,8aS)-1-[(3R)-3-Hydroxy-3-méthyl-4-pentèn-1-yl]-2,5,5,8a-tétraméthyldécahydro-2-naphtalénol

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
398.3±15.0 °C at 760 mmHg

[ Melting Point ]:
95-100 °C(lit.)

[ Molecular Formula ]:
C20H36O2

[ Molecular Weight ]:
308.499

[ Flash Point ]:
169.1±15.0 °C

[ Exact Mass ]:
308.271515

[ PSA ]:
40.46000

[ LogP ]:
5.54

[ Vapour Pressure ]:
0.0±2.1 mmHg at 25°C

[ Index of Refraction ]:
1.490

[ Storage condition ]:
2-8C

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QK0301900
CHEMICAL NAME :
1-Naphthalenepropanol, decahydro-alpha-ethenyl-2-hydroxy-alpha,2,5,5,8a-pent amethyl-, (1R-(1-alpha(R*),2-beta,4a-beta,8a-alpha))-
CAS REGISTRY NUMBER :
515-03-7
BEILSTEIN REFERENCE NO. :
2054148
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C20-H36-O2
MOLECULAR WEIGHT :
308.56

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 30,115S,1992
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 30,115S,1992

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
QK0301900

[ HS Code ]:
2906199090

Synthetic Route

Precursor & DownStream

Precursor

  • 1-Naphthalenepropanol,2-(acetyloxy)-a-ethenyldecahydro-a,2,5,5,8a-pentamethyl-,acetate,(aR,1R,2R,4aS,8aS)- (9CI)
  • 8,17-epoxy-14-labden-13-ol
  • Manool

DownStream

  • (1S,4aS,8aS)-Decahydro-5,5,8a-trimethyl-2-methylene-1-naphthaleneacetaldehyde
  • Totarol
  • Ambrox
  • [(1R,2R,4aS,8aS)-decahydro-2-hydroxy-2,5,5,8a-tetramethylnaphthalen-1-yl]ethanal
  • Sclareolide
  • 8-Acetoxy-13,14,15,16-tetranorlabdane-12-oic acid
  • (1R,8aS)-1-carbomethoxymethyl-5,5,8a-trimethyl-2-oxo-trans-decalin
  • (3R,4aS,6aR,10aR,10bS)-3-ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromene
  • (3S,6aα,10bα)-Dodecahydro-3,4aβ,7,7,10aβ-pentamethyl-3β-vinyl-1H-naphtho[2,1-b]pyran

Customs

[ HS Code ]: 2906199090

[ Summary ]:
2906199090. cyclanic, cyclenic or cyclotherpenic alcohols. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

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Related Compounds

  • .Sclareol
  • Episclareol
  • (-)-sclareol
  • 3-β sclareol
  • epoxysclareol
  • sclareol oxide
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  • 4-cyclobutyl-6-{3-[(4-methyl-1H-pyrazol-1-yl)methyl]azetidin-1-yl}pyrimidine
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  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine