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HEPTYL ACETATE Structure

HEPTYL ACETATE

  • Product NameHEPTYL ACETATE
  • CAS112-06-1
  • CBNumberCB5355567
  • MFC9H18O2
  • MW158.24
  • EINECS203-932-8
  • MDL NumberMFCD00027311
  • MOL File112-06-1.mol

Chemical Properties

Melting point: −50 °C (−58 °F; 223 K)
Boiling point: 192 to 193 °C (378 to 379 °F; 465 to 466 K)
Density  0.862 - 0.872 g/cm3
vapor density  5.5 (vs air)
vapor pressure  12 mm Hg ( 73 °C)
FEMA  2547 | HEPTYL ACETATE
refractive index  1.41
Flash point: 69 °C
storage temp.  Store at room temperature
form  clear liquid
color  Colorless
Specific Gravity 0.866~0.874 (20/4℃)
Odor at 100.00 %. fresh green rum ripe fruit pear apricot woody
Odor Type green
biological source synthetic
Thermal Conductivity 0.128 W/(m·K) at 25 ℃
JECFA Number 129
Henry's Law Constant 1.2×10-2 mol/(m3Pa) at 25℃, Yaws (2003)
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C9H18O2/c1-3-4-5-6-7-8-11-9(2)10/h3-8H2,1-2H3
InChIKey ZCZSIDMEHXZRLG-UHFFFAOYSA-N
SMILES CCCCCCCOC(C)=O
LogP 3.37
CAS DataBase Reference 112-06-1(CAS DataBase Reference)
NIST Chemistry Reference Acetic acid, heptyl ester(112-06-1)
EPA Substance Registry System Acetic acid, heptyl ester (112-06-1)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H227
Precautionary statements  P210-P280-P370+P378-P403+P235-P501
PPE Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
Risk Statements  38
Safety Statements  15
WGK Germany  2
RTECS  AH9901000
TSCA  TSCA listed
HS Code  2915390090
Storage Class 10 - Combustible liquids
Toxicity Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg
NFPA 704:
2
0 0

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HEPTYL ACETATE Chemical Properties,Usage,Production

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