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3,7-DIMETHYL-2-trans-6-OCTADIENYL CROTONATE

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Name

3,7-DIMETHYL-2-trans-6-OCTADIENYL CROTONATE

EINECS N/A
CAS No. 56172-46-4 Density 0.912g/cm3
PSA 26.30000 LogP 3.79840
Solubility N/A Melting Point N/A
Formula C14H22 O2 Boiling Point 303.8°Cat760mmHg
Molecular Weight 222.327 Flash Point 144.6°C
Transport Information N/A Appearance N/A
Safety Low toxicity by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS. Risk Codes N/A
Molecular Structure Molecular Structure of 56172-46-4 (GERANYL CROTONATE) Hazard Symbols N/A
Synonyms

2-Butenoicacid, (2E)-3,7-dimethyl-2,6-octadienyl ester (9CI); 2-Butenoic acid,3,7-dimethyl-2,6-octadienyl ester, (?,E)-; Geranyl crotonate

 

3,7-DIMETHYL-2-trans-6-OCTADIENYL CROTONATE Chemical Properties

MF: C14H22O2
MW: 222.32
EINECS: 260-027-0 
Density: 0.912 g/cm3
Flash Point:  144.6 °C
Index of Refraction: 1.474 
Refractive index: 1.4364-1.4384
Enthalpy of Vaporization: 54.41 kJ/mol 
Boiling Point: 303.8 °C at 760 mmHg 
Vapour Pressure: 0.00091 mmHg at 25°C  
Odor description: sweet caramel maple fruity almond acorns nutty
IUPAC Name: [(2E)-3,7-Dimethylocta-2,6-dienyl] (E)-but-2-enoate
Appearence3,7-Dimethyl-2-trans,6-octadienyl crotonate (CAS NO.56172-46-4): colorless clear liquid
Synonyms: Geranyl crotonate ; 2-Butenoicacid,(2E)-3,7-dimethyl-2,6-octadienylester ; 2-Butenoicacid,3,7-dimethyl-2,6-octadienylester ; 3,7-Dimethyl-,2-butenoate,(E)-6-octadien-1-ol ; 3,7-Dimethyl-2,6-octadienylester,(?,e)-2-butenoicaci ; 3,7-Dimethyl-2-trans,6-octadienylcrotonate ; Crotonicacid,geraniolester ; Geraniolcrotonate
Following is the molecular structure of 3,7-Dimethyl-2-trans,6-octadienyl crotonate (CAS NO.56172-46-4):

3,7-DIMETHYL-2-trans-6-OCTADIENYL CROTONATE Uses

 3,7-Dimethyl-2-trans,6-octadienyl crotonate (CAS NO.56172-46-4) is used as perfuming agents in Cosmetic.

3,7-DIMETHYL-2-trans-6-OCTADIENYL CROTONATE Toxicity Data With Reference

1.    

skn-rbt 500 mg/24H MOD

    FCTXAV    Food and Cosmetics Toxicology. 12 (1974),891.
2.    

orl-rat LD50:>5 g/kg

    FCTXAV    Food and Cosmetics Toxicology. 12 (1974),891.
3.    

skn-rbt LD50:>5 g/kg

    FCTXAV    Food and Cosmetics Toxicology. 12 (1974),891.

3,7-DIMETHYL-2-trans-6-OCTADIENYL CROTONATE Consensus Reports

Reported in EPA TSCA Inventory.

3,7-DIMETHYL-2-trans-6-OCTADIENYL CROTONATE Safety Profile

Low toxicity by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.

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