ChemicalBook--->CAS DataBase List--->5655-61-8

5655-61-8

5655-61-8 Structure

5655-61-8 Structure
IdentificationMore
[Name]

L-BORNYL ACETATE
[CAS]

5655-61-8
[Synonyms]

ACETIC ACID L-BORNYL ESTER
(-)-BORNYL ACETATE
(+)-BORNYL ACETATE
BORNYL ACETATE
BORNYL ACETATE, L-
ENDO-(1R)-1,7,7-TRIMETHYLBICYCLO[2.2.1]HEPT-2-YL-ACETATE
ENDO-(1S)-1,7,7-TRIMETHYLBICYCLO[2.2.1]HEPT-2-YL ACETATE
FEMA 2159
L-BORNEOL ACETATE
L-(-)-BORNYL ACETATE
L-BORNYL ACETATE
L-BORNYL ACETIC ETHER
1,7,7-trimethyl-,acetate,(1s-endo)-bicyclo[2.2.1]heptan-2-o
1,7,7-trimethyl-,acetate,(1S-endo)-Bicyclo[2.2.1]heptan-2-ol
Bicyclo[2.2.1]heptan-2-ol,1,7,7-trimethyl-,acetate,(1S-endo)-
Borneol, acetate, (1S,2R,4S)-(-)-
L-alpha-bornyl acetate
Levo-bornyl acetate
(1S,2R,4S)-bornyl acetate
L-born-2-yl acetate
[EINECS(EC#)]

243-750-6
[Molecular Formula]

C12H20O2
[MDL Number]

MFCD00135942
[Molecular Weight]

196.29
[MOL File]

5655-61-8.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless liquid
[Melting point ]

27°C
[Boiling point ]

223-224 °C(lit.)
[density ]

0.984g/mL20°C
[vapor pressure ]

0.6 mm Hg ( 20 °C)
[FEMA ]

4080 | L-BORNYL ACETATE
[refractive index ]

n20/D 1.463
[Fp ]

184 °F
[storage temp. ]

-20°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Liquid
[color ]

Clear colorless
[Odor]

at 100.00 %. sweet balsamic woody fresh pine needle herbal
[Odor Type]

balsamic
[Optical Rotation]

[α]20/D 46±2°, c = 1% in ethanol
[Water Solubility ]

62.6mg/L at 20℃
[JECFA Number]

1864
[Merck ]

14,1339
[BRN ]

2502036
[Henry's Law Constant]

3.8×10-4 mol/(m3Pa) at 25℃, Copolovici and Niinemets (2015)
[Major Application]

cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
[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
[SMILES]

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

3.74 at 20℃
[CAS DataBase Reference]

5655-61-8(CAS DataBase Reference)
[EPA Substance Registry System]

Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, acetate, (1S,2R,4S)- (5655-61-8)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H227
[Precautionary statements ]

P210-P280-P370+P378-P403+P235-P501-P210e-P280a-P370+P378a-P501a
[Hazard Codes ]

Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[RIDADR ]

NA 1993 / PGIII
[WGK Germany ]

1
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29153900
[Storage Class]

10 - Combustible liquids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Borneol oil-->L(-)-Borneol
Hazard InformationBack Directory
[Chemical Properties]

clear colorless liquid
[Chemical Properties]

Colorless solid; sweet herbaceous aroma.
[Occurrence]

Reported found in carrot, coriander, spike lavender, pine needle, rosemary, sage and valerian root.
[Uses]

(?)-Bornyl acetate can be used:
  • As a key intermediate in the preparation of camphor.
  • To prepare (?)-englerin A, an anti-cancer agent.

[Preparation]

By esterification of laevo-Bomeol. On account of its high melting point it can also be isolated from a mixture of isomers. dextro-Bornyl acetate is produced from dextro-Borneol (esterification with Acetic anhydride and Sodium acetate).
[Aroma threshold values]

Medium strength odor, balsamic type.
[General Description]

Produced and qualified by HWI pharma services GmbH.
Exact content by quantitative NMR can be found on the certificate.
[Flammability and Explosibility]

Nonflammable
Spectrum DetailBack Directory
[Spectrum Detail]

L-BORNYL ACETATE(5655-61-8)1HNMR
L-BORNYL ACETATE(5655-61-8)Raman
L-BORNYL ACETATE(5655-61-8)IR
L-BORNYL ACETATE(5655-61-8)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

L-Bornyl acetate, 95%(5655-61-8)
[Alfa Aesar]

L-(-)-Bornyl acetate, 95%(5655-61-8)
[Sigma Aldrich]

5655-61-8(sigmaaldrich)
[TCI AMERICA]

Bornyl Acetate  (contains ca. 20% Isobornyl Acetate),>70.0%(GC)(5655-61-8)
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