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(-)-Isocaryophyllene

Catalog_Number:

DB-061346

CAS:

118-65-0

Formula:

C15H24

Formula_Weight:

204.357g/mol

Purity:

95%
NOTICE: THE PRODUCT IS JUST ONLY FOR LAB RESEARCH, NOT FOR OTHER USE.
IUPAC_Name: (1R,4Z,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
InChI InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3
InChiKey NPNUFJAVOOONJE-UHFFFAOYSA-N
Synonyms:

Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, (1R,4Z,9S)-

(1R,4Z,9S)-4,11,11-Trimethyl-8-methylenbicyclo[7.2.0]undec-4-en

(1R,4Z,9S)-4,11,11-Triméthyl-8-méthylènebicyclo[7.2.0]undéc-4-ène

Canonical SMILES: CC1=CCCC(=C)C2CC(C2CC1)(C)C
Physical Description:

PHYSICAL DESCRIPTION: Pale yellow oily liquid with an odor midway between odor of cloves and turpentine. (NTP, 1992)

Density: 0.9075 at 68° F (NTP, 1992)
Boiling Point: 264 to 266° F at 14 mm Hg (NTP, 1992)
Flash Point: 214° F (NTP, 1992)
Solubility: less than 1 mg/mL at 70° F (NTP, 1992)
Density: 0.9075 at 68° F (NTP, 1992)
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 48.6±0.8 kJ/mol
Index of Refraction: 1.495
Molar Refractivity: 66.6±0.4 cm3
Experimental Boiling Point: 116 °C / 10 mmHg (273.4392 °C / 760 mmHg)
Experimental Flash Point: 97 °C
Reactive Group: Hydrocarbons, Aliphatic Unsaturated
Health Hazard: SYMPTOMS: This chemical causes irritation of the skin. ACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits acrid smoke and irritating fumes. (NTP, 1992)
Fire Hazard: This chemical is combustible. (NTP, 1992)
GHS Classification:
Signal: Danger
GHS Hazard Statements
Aggregated GHS information provided by 1164 companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Reported as not meeting GHS hazard criteria by 2 of 1164 companies. For more detailed information, please visit ECHA C&L website

Of the 7 notification(s) provided by 1162 of 1164 companies with hazard statement code(s):

H304 (99.31%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]
H317 (65.4%): May cause an allergic skin reaction [Warning Sensitization, Skin]

Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown.

Precautionary Statement Codes
P261, P272, P280, P301+P310, P302+P352, P321, P331, P333+P313, P363, P405, and P501
Air and Water Reactions: Insoluble in water.
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