7549-37-3

Name 1,1-Dimethoxy-3,7-dimethylocta-2,6-diene
CAS 7549-37-3
EINECS(EC#) 231-434-0
Molecular Formula C12H22O2
MDL Number MFCD00008909
Molecular Weight 198.3
MOL File 7549-37-3.mol

Chemical Properties

Boiling point  105-106 °C10 mm Hg(lit.)
density  0.89 g/mL at 25 °C(lit.)
vapor density  6.8 (vs air)
vapor pressure  9 mm Hg ( 102.7 °C)
FEMA  2305
refractive index  n20/D 1.454(lit.)
Fp  180 °F
form  clear liquid
color  Colorless to Almost colorless
Odor at 100.00 %. green floral citric lemon lime natural
biological source synthetic
Odor Type citrus
Water Solubility  Almost insoluble in water
JECFA Number 944
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C12H22O2/c1-10(2)7-6-8-11(3)9-12(13-4)14-5/h7,9,12H,6,8H2,1-5H3/b11-9+
InChIKey ZSKAJFSSXURRGL-PKNBQFBNSA-N
SMILES COC(OC)\C=C(/C)CC\C=C(\C)C
LogP 3.76
CAS DataBase Reference 7549-37-3(CAS DataBase Reference)
NIST Chemistry Reference 3,7-Dimethyl-2,6-octadienal, dimethyl acetal(7549-37-3)
EPA Substance Registry System 7549-37-3(EPA Substance)

Safety Data

Hazard Codes  Xi
Risk Statements 
R43:May cause sensitization by skin contact.
Safety Statements 
S36/37:Wear suitable protective clothing and gloves .
WGK Germany  2
RTECS  RG5330000
Hazard Note  Irritant
TSCA  TSCA listed
HS Code  2911.00.5000
Storage Class 10 - Combustible liquids
Toxicity
Both the oral LD50 value in rats and the dermal LD50 value in rabbits exceeded 5 g/kg (Hart, 1971).

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