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16409-44-2

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Basic Information
CAS No.: 16409-44-2
Name: GERANYL ACETATE
Article Data: 18
Molecular Structure:
Molecular Structure of 16409-44-2 (GERANYL ACETATE)
Formula: C12H20 O2
Molecular Weight: 196.29
Synonyms: 2,6-Octadien-1-ol,3,7-dimethyl-, acetate (8CI,9CI); 2,6-Dimethyl-2,6-octadien-8-yl acetate;3,7-Dimethyl-2,6-octadien-1-yl acetate; 3,7-Dimethyl-2,6-octadienyl acetate
EINECS: 240-458-0
Density: 0.904 g/cm3
Melting Point: <25 °C
Boiling Point: 247.5 °C at 760 mmHg
Flash Point: 98.9 °C
Solubility: 28.8mg/L at 24℃
Hazard Symbols: IrritantXi
Risk Codes: R36/37/38
Safety: S26-36
PSA: 26.30000
LogP: 3.24220
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Chemistry

Product Name: Geraniol acetate (CAS NO.16409-44-2)


Molecular Formula: C12H20O2
Molecular Weight: 196.29g/mol
Mol File: 16409-44-2.mol
Einecs: 240-458-0
Melting Point: <25 °C
Boiling point: 247.5 °C at 760 mmHg
Storage Temperature: 2-8°C
Flash Point: 98.9 °C
Density: 0.916 g/mL at 25 °C
Refractive index: n20/D 1.462
Surface Tension: 28.4 dyne/cm
Enthalpy of Vaporization: 48.47 kJ/mol
Vapour Pressure: 0.0256 mmHg at 25°C
XLogP3-AA: 3.5
H-Bond Donor: 0
H-Bond Acceptor: 2
Structure Descriptors of Geraniol acetate (CAS NO.16409-44-2):
  IUPAC Name: 3,7-dimethylocta-2,6-dienyl acetate
  Canonical SMILES: CC(=CCCC(=CCOC(=O)C)C)C
  InChI: InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3 
  InChIKey: HIGQPQRQIQDZMP-UHFFFAOYSA-N

Uses

 Geraniol acetate (CAS NO.16409-44-2) is an ester that can be prepared semi-synthetically by the simple condensation of the more common natural terpene geraniol with acetic acid.
 Geraniol acetate (CAS NO.16409-44-2) is used primarily as a component of perfumes for creams and soaps and as a flavoring ingredient. It is used particularly in rose, lavender and geranium formulations where a sweet fruity or citrus aroma is desired.

Safety Profile

Safety Information of Geraniol acetate (CAS NO.16409-44-2):
Hazard Codes: XiIrritant
Risk Statements: 36/37/38
36:  Irritating to the eyes 
37:  Irritating to the respiratory system 
38:  Irritating to the skin 
Safety Statements: 26-36
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
36:  Wear suitable protective clothing 

Specification

 Geraniol acetate ,its CAS NO. is 16409-44-2,the synonyms is EINECS 240-458-0 ; 3,7-Dimethylocta-2,6-dienyl acetate .