CAS No.5655-61-8,L-BORNYL ACETATE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	5655-61-8
Name:	L-BORNYL ACETATE
Article Data:	87

Formula:	C₁₂H₂₀O₂
Molecular Weight:	196.29
Synonyms:	Bicyclo[2.2.1]heptan-2-ol,1,7,7-trimethyl-, acetate, (1S,2R,4S)- (9CI);Bicyclo[2.2.1]heptan-2-ol,1,7,7-trimethyl-, acetate, (1S-endo)-;Borneol, acetate, (1S,2R,4S)-(-)- (8CI);Borneol, l-, acetate (6CI);(-)-Bornyl acetate;(1S-endo)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-yl acetate;1S-endo-Bornylacetate;l-Bornyl acetate;levo-Bornyl acetate;6626-35-3;
EINECS:	243-750-6
Density:	1 g/cm³
Melting Point:	27°C
Boiling Point:	223.5 °C at 760 mmHg
Flash Point:	84.4 °C
Solubility:	62.6mg/L at 20℃
Appearance:	clear colorless liquid
Hazard Symbols:	Xn
Risk Codes:	20/21/22-36/37/38
Safety:	23-24/25-36-26
PSA:	26.30000
LogP:	2.76430

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Specification

The CAS register number of (-)-Bornyl acetate is 5655-61-8. It also can be called as Bicyclo[2.2.1]heptan-2-ol,1,7,7-trimethyl-, 2-acetate, (1S,2R,4S)- and the IUPAC name about this chemical is [(1S,3R,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] acetate. The molecular formula about this chemical is C₁₂H₂₀O₂ and the molecular weight is 196.29. It belongs to the following product categories which include Bicyclic Monoterpenes; Biochemistry; Terpenes and so on.

Physical properties about (-)-Bornyl acetate are: (1)ACD/LogP: 3.60 ; (2)ACD/LogD (pH 5.5): 3.6; (3)ACD/LogD (pH 7.4): 3.6; (4)ACD/BCF (pH 5.5): 321.98; (5)ACD/BCF (pH 7.4): 321.98; (6)ACD/KOC (pH 5.5): 2171.25; (7)ACD/KOC (pH 7.4): 2171.25; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 26.3Å²; (11)Index of Refraction: 1.48; (12)Molar Refractivity: 55.34 cm³; (13)Molar Volume: 194.7 cm³; (14)Polarizability: 21.94x10^-24cm³; (15)Surface Tension: 32.6 dyne/cm; (16)Flash Point: 84.4 °C; (17)Enthalpy of Vaporization: 46 kJ/mol; (18)Boiling Point: 223.5 °C at 760 mmHg; (19)Vapour Pressure: 0.0959 mmHg at 25°C.

This chemical can be separated from the distillation of fir oil. In industry, bornyl acetate can react with acetic acid, then heat they at sodium acetate can get (-)-Bornyl acetate. This chemical is widely used in soap, cosmetics and aromatic room disinfection cleaning.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed. It is irritating to eyes, respiratory system and skin. If you want to use this chemical, please avoid contact with skin and eyes. When you are using it, wear suitable protective clothing and do not breathe vapour. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C)C
(2)InChI: InChI=1/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
(3)InChIKey: KGEKLUUHTZCSIP-HOSYDEDBBJ
(4)Std. 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
(5)Std. InChIKey: KGEKLUUHTZCSIP-HOSYDEDBSA-N