(1R,2R,4aS,8aS)-1-[(3R)-3-Hydroxy-3-methyl-4-penten-1-yl]-2,5,5,8a-tetramethyldecahydro-2-naphthalenol

Basic Information

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CAS Number

515-03-7

Molecular Formula

C20H36O2

Molecular Weight

308.51 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Physical State

Powder

Melting Point

95-100 °C

Boiling Point

218-220 °C/19 mmHg

Solubility

Practically insoluble or insoluble in water

Specific Rotation

-13 º (c=4, in carbon tetrachloride)

SMILES

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O[C@@]1(C)[C@H](CC[C@@](C)(O)C=C)[C@@]2(C)CCCC(C)(C)[C@]2([H])CC1

InChI

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

LogP

4.697200000000005

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

429

Safety Information

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GHS Hazard Pictograms

H319

Hazard Statement

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Storage Conditions

2-8℃

Synonyms & References

English

Sclareol
(1R,2R,8AS)-DECAHYDRO-1-(3-HYDROXY-3-METHYL-4-PENTENYL)-2,5,5,8A-TETRAMETHYL-2-NAPHTHOL
(13r)-labd-14-ene-13-diol
(1r-(1-alpha(r*),2-beta,4a-beta,8a-alpha))-thyl
[1theta-[1alpha(theta),2beta,4abeta,8aalpha]]-thyl
1-(3-Hydroxy-3-methyl-4-pentenyl)-2,5,5,8a-tetramethyldecahydro-2-naphthalenol
1-Naphthalenepropanol, alpha-ethenyldecahydro-2-hydroxy-alpha,2,5,5,8a-pentamethyl-, [1R-[1alpha(R*),2beta,4abeta,8aalpha]]-
SCLAREOL(AS)
SCLAREOL(P)
(-)-sclareol
labd-14-ene-8,13(R)-diol
SCAREOL
SCIADONIC ACID
SCLAREOL(RG)
SCLAREOL,NATURAL
Labd-14-ene-8,13-diol
B607NP0Q8Y
Sclareol (natural)
(1R,2R,4aS,8aS)-1-((R)-3-hydroxy-3-methylpent-4-en-1-yl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol
C20H36O2
Sclareol (6CI)
(-)-Sclareol

MDL Number

MFCD00869558

Customs Code

2906199090

FAQ

What is (1R,2R,4aS,8aS)-1-[(3R)-3-Hydroxy-3-methyl-4-penten-1-yl]-2,5,5,8a-tetramethyldecahydro-2-naphthalenol (CAS: 515-03-7)?

This is a complex organic compound with the CAS number 515-03-7. It belongs to the class of terpene derivatives and is characterized by its branched structure and multiple methyl groups. The compound is known for its specific stereochemistry, with the (1R,2R,4aS,8aS) configuration, and exhibits properties typical of alcohols, such as solubility in organic solvents and potential use in fragrance or pharmaceutical applications.

What are the main uses of (1R,2R,4aS,8aS)-1-[(3R)-3-Hydroxy-3-methyl-4-penten-1-yl]-2,5,5,8a-tetramethyldecahydro-2-naphthalenol (CAS: 515-03-7)?

This compound is primarily used in the pharmaceutical industry as a precursor in the synthesis of various bioactive molecules. It also finds applications in the fragrance industry due to its potential aromatic properties. Additionally, it may be used in research for studying molecular structures and as an intermediate in organic synthesis processes.

Is (1R,2R,4aS,8aS)-1-[(3R)-3-Hydroxy-3-methyl-4-penten-1-yl]-2,5,5,8a-tetramethyldecahydro-2-naphthalenol (CAS: 515-03-7) safe?

The safety of this compound depends on its application and exposure conditions. It should be handled with care in industrial and laboratory settings, as it may have potential toxicity if inhaled or ingested. Proper protective measures such as gloves, goggles, and ventilation are recommended. Safety standards for handling this compound are typically aligned with those for similar organic chemicals, emphasizing controlled exposure and safe disposal.

How should (1R,2R,4aS,8aS)-1-[(3R)-3-Hydroxy-3-methyl-4-penten-1-yl]-2,5,5,8a-tetramethyldecahydro-2-naphthalenol (CAS: 515-03-7) be stored?

This compound should be stored in a cool, dry, and well-ventilated area, away from direct light. It is best kept in a sealed, airtight container to prevent moisture absorption and degradation. Storage conditions should maintain a temperature below 25°C and humidity levels below 60% to ensure stability and prolong shelf life.