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1118-39-4

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Basic Information
CAS No.: 1118-39-4
Name: PSEUDO LINALYL ACETATE
Article Data: 6
Molecular Structure:
Molecular Structure of 1118-39-4 (PSEUDO LINALYL ACETATE)
Formula: C12H20 O2
Molecular Weight: 196.29
Synonyms: 7-Octen-2-ol,2-methyl-6-methylene-, acetate (8CI,9CI); Myrcenol, acetate (6CI); Myrcenylacetate; Neobergamate
Density: 0.891g/cm3
Boiling Point: 257.2°C at 760 mmHg
Flash Point: 90.4°C
Solubility: 49.6mg/L at 24℃
Safety: Mildly toxic by ingestion. A skin irritant. See also ESTERS. When heated to decomposition it emits acrid smoke and irritating fumes.
PSA: 26.30000
LogP: 3.24060
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Chemistry

Molecular Structure of Acetic acid myrcenyl ester (CAS NO.1118-39-4):

IUPAC Name: (2-methyl-6-methylideneoct-7-en-2-yl) acetate
Empirical Formula: C12H20O2 
Molecular Weight: 196.286 
Index of Refraction: 1.445 
Surface Tension: 27.3 dyne/cm
Density: 0.891 g/cm3 
Flash Point: 90.4 °C
Enthalpy of Vaporization: 49.47 kJ/mol 
Boiling Point: 257.2 °C at 760 mmHg
Vapour Pressure: 0.0147 mmHg at 25°C 
Synonyms of Acetic acid myrcenyl ester (CAS NO.1118-39-4): 2-methyl-6-methylene-7-octen-2-oacetate;2-methyl-6-methylene-7-octen-2-ylacetate;3-methylene-7-methyl-1-octen-7-ylacetate;aceticacid,2-methyl-6-methylene-7-octen-2-ylester;aceticacid,myrcenylester;myrcenyl;2-Acetoxy-2-methyl-6-methylene-7-octene;7-octen-2-ol, 2-methyl-6-methylene:acetate

Toxicity Data With Reference

1.    

skn-rbt 500 mg/24H MOD

     FCTXAV    Food and Cosmetics Toxicology. 14 (1976),601.
2.    

orl-rat LD50:6300 mg/kg

     FCTXAV    Food and Cosmetics Toxicology. 14 (6)(1976),601.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

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

Specification

 Acetic acid, 2-(2-(2-methoxyethoxy) ethoxy)ethyl ester (CAS NO.3610-27-3) is a low-toxic material, flammable,thermal decomposition would release stimulation Smoke,it should be stored in low temperature, ventilation, drying environmental conditions,separated with food and raw materials, besides water, carbon oxides and oxidation of toxic carbon dioxide, dry powder, sand, water mist fire extinguishing agent can be used if emergency.