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L-bornyl acetate

CAS 5655-61-8C12H20O2MW 196.15 g/mol

L-bornyl acetate (CAS 5655-61-8) — formula C12H20O2, molecular weight 196.15 g/mol; category organic chemicals.

Specifications

CAS Number5655-61-8
Molecular FormulaC12H20O2
Molecular Weight196.15 g/mol
Boiling Point226 °C
LogP3.3
CategoryOrganic Chemicals

Purchase Profile

What this product is

L-bornyl acetate is a carbon-based organic compound with CAS registry number 5655-61-8 and molecular formula C12H20O2 (molecular weight 196.15 g/mol), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 5655-61-8

Its molecular formula C12H20O2 comprises 12 C, 20 H, 2 O atoms.

Also known as: L-bornyl acetate · Bornyl Acetate

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of L-bornyl acetate?

The CAS registry number of L-bornyl acetate is 5655-61-8.

What is the molecular formula and molecular weight of L-bornyl acetate?

Molecular formula C12H20O2, molecular weight 196.15 g/mol.

What other names is L-bornyl acetate known by?

It is also registered under: L-bornyl acetate, Bornyl Acetate.

Which category does L-bornyl acetate belong to?

Category: Organic Chemicals.

PubChem Public Data

Public-database records for L-bornyl acetate (CAS 5655-61-8), reproduced here for independent cross-checking.

Safety classification and hazard statements

GHS notification summary100% (1557 / 1557)

This chemical does not meet GHS hazard criteria for 100% (1557 of 1557) of all reports.

Reported as not meeting GHS hazard criteria by 1557 of 1557 companies. For more detailed information, please visit ECHA C&L website.

Regulatory listings

Regulatory & Food ContactEU Flavoring substances
FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
Herb, Pine
Floral
GHS notification summary100% (1557 / 1557)

Physical description and handling notes

  • Solid; mp = 24 or 27 deg C; [Merck Index] Colorless or white clear liquid or crystals with a sweet, woody, fresh pine needle odor; mp = 27-29 deg C; [Good Scents MSDS]
  • Colourless liquid, semicrystaline mass to white crystaline solid; Sweet herbaceous, piney aroma
  • Colourless solid; Sweet herbaceous odour
  • Slightly soluble in water; Insoluble in glycerin, propylene glycol
  • Soluble (in ethanol)
  • Practically insoluble to insoluble in water

Reported physical properties

沸点226 °C
沸点224-226 °C
密度0.981-0.985
密度0.981-0.987
蒸气压0.6 [mmHg]
折射率1.462-1.466
折射率1.456-1.462

How this substance is indexed

CAS Registry Number5655-61-8
PubChem CID93009
分子式C12H20O2
分子量196.15 g/mol
IUPAC 名称[(1S,2R,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] acetate
InChIKeyKGEKLUUHTZCSIP-SQLBVSGCSA-N
UNII（FDA）24QAP1VCUX
FEMA 编号2159
JECFA 编号1864

Documented uses

  • Naturally occurring bornyl acetate--occurs in the essential oils of some plants; Used in fragrances and flavors; [Merck Index] Used as a flavoring agent; [FDA]
  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Flavoring Agents -> JECFA Flavorings Index
  • Information on 1 consumer products that contain Bornyl acetate [USAN] in the following categories is provided:
  • Information on 1 consumer products that contain L-Bornyl Acetate in the following categories is provided:
  • Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, 2-acetate, (1R,2S,4R)-rel-: ACTIVE

Names this substance appears under

(-)-Bornyl acetate; 5655-61-8; L-bornyl acetate; (-)-Borneol acetate; Bornyl acetate, (-)-; Levo-bornyl acetate; UNII-24QAP1VCUX; 24QAP1VCUX; Borneol, acetate, (1S,2R,4S)-(-)-; EINECS 227-101-4; BORNYL ACETATE, L-; BORNYL ACETATE L-FORM; BORNEOL, L-, ACETATE; 1S-ENDO-BORNYL ACETATE; FEMA NO. 4080; BORNEOL ACETATE, (-)-

Computed molecular descriptors

分子量196.29
XLogP33.3
氢键供体数0
氢键受体数2
可旋转键数2
精确质量196.146329876
单同位素质量196.146329876
拓扑极性表面积26.3
重原子数14
形式电荷0

Database abstract

L-bornyl acetate is identified by CAS 5655-61-8, molecular formula C12H20O2 and molecular weight 196.15 g/mol. UNII 24QAP1VCUX; InChIKey KGEKLUUHTZCSIP-SQLBVSGCSA-N. 沸点: 226 °C; 沸点: 224-226 °C; 密度: 0.981-0.985.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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