(1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate

Basic Information

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CAS Number

5655-61-8

Molecular Formula

C12H20O2

Molecular Weight

196.29 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Oil

Melting Point

27°C

Boiling Point

223-224 °C

Refractive Index

n20/D 1.463(lit.)

Vapor Pressure

0.6 mmHg ( 20 °C)

Specific Rotation

-41 º (NEAT)

SMILES

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CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C

InChI

InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10+,12+/m0/s1

InChIKey

KGEKLUUHTZCSIP-HOSYDEDBSA-N

LogP

2.7643000000000013

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

270

Safety Information

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GHS Hazard Pictograms

H227

Hazard Statement

H227 Combustible liquid
Flammable liquids

Synonyms & References

English

L-Bornyl acetate
(1S,2R,4S)-bornyl acetate
L-Born-2-yl acetate
L-(-)-Bornyl acetate
(-)-Bornyl acetate
(?)-Bornyl acetate
(−)-Bornyl acetate
BORNYL ACETATE, L-(AS)
Borneol, acetate, (1S,2R,4S)-(-)-
Levo-bornyl acetate
L-α-bornyl acetate
L-Borneol acetate
(-)-[(1S)-bornyl]-acetate
(1S)-1,7,7-Trimethylbicyclo[2.2.1]-2-heptanol acetate
(1S-endo)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-yl acetate
1S-endo-Bornyl acetate
l-Bornyl acetate
levo-Bornyl acetate
(1S,2R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl acetate

MDL Number

MFCD00867808

FAQ

What regulatory guidelines apply to (1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate (CAS: 5655-61-8)?

The compound (1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate (CAS: 5655-61-8) falls under the GHS (Global Harmonized System of Classification and Labeling of Chemicals) for classification and labeling. It must comply with REACH regulations, ensuring supplier registration and safety data sheets are available. FDA and EPA regulations also apply, requiring compliance with Good Manufacturing Practices and environmental protection standards.

Are there alternatives to (1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate in synthesis (CAS: 5655-61-8)?

Synthesizing (1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate (CAS: 5655-61-8), consider using (R)-(-)-Borneol as a precursor. Isomers (2S,3S)- and (2R,3R)-Borneol are also viable alternatives. Other common reagents like (S)-(-)-Borneol could be used as substitutes in similar reactions.

What is the market or research trend for (1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate (CAS: 5655-61-8)?

The market for (1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate (CAS: 5655-61-8) is growing with increasing demand in pharmaceuticals and fragrances. Research trends focus on its potential in new drug development and improving its synthetic methods for cost-effectiveness and scalability. Emerging studies also explore its applications in cosmetic ingredients and natural product chemistry.

How should waste containing (1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate (CAS: 5655-61-8) be handled?

Waste containing (1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate (CAS: 5655-61-8) should be collected in a sealed container and stored in a well-ventilated area. Incineration should be conducted at a licensed facility, following local regulations. For large quantities, professional waste disposal services are recommended. Always ensure proper environmental protection measures, including the use of appropriate personal protective equipment (PPE) and emergency protocols.