123-96-6

Name DL-2-Octanol
CAS 123-96-6
EINECS(EC#) 204-667-0
Molecular Formula C8H18O
MDL Number MFCD00004591
Molecular Weight 130.23
MOL File 123-96-6.mol

Chemical Properties

Appearance colourless liquid with a pungent odour
Melting point  -38 °C
Boiling point  174-181 °C(lit.)
density  0.819 g/mL at 25 °C(lit.)
vapor pressure  0.25 hPa (20 °C)
FEMA  2801
refractive index  n20/D 1.426(lit.)
Fp  160 °F
storage temp.  Store below +30°C.
solubility  1.12g/l
form  Liquid
pka 15.44±0.20(Predicted)
color  Clear colorless to slightly yellow
Odor at 10.00 % in dipropylene glycol. fresh spicy green woody herbal earthy
Stability: Stable. Incompatible with strong oxidizing agents. Combustible.
biological source synthetic
explosive limit 0.80-7.40%(V)
Odor Type spicy
Water Solubility  0.1 g/100 mL (20 ºC)
JECFA Number 289
Merck  14,6752
BRN  1719325
Henry's Law Constant 2.7×10-1 mol/(m3Pa) at 25℃, Brockbank (2013)
Dielectric constant 5.3(20℃)
Major Application cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C8H18O/c1-3-4-5-6-7-8(2)9/h8-9H,3-7H2,1-2H3
InChIKey SJWFXCIHNDVPSH-UHFFFAOYSA-N
SMILES CCCCCCC(C)O
LogP 2.86 at 22℃
CAS DataBase Reference 123-96-6(CAS DataBase Reference)
NIST Chemistry Reference 2-Octanol(123-96-6)
EPA Substance Registry System 123-96-6(EPA Substance)

Safety Data

Symbol(GHS)  Corrosion (GHS05)
GHS05
Signal word  Danger
Hazard statements  H318
Precautionary statements  P280-P305+P351+P338+P310
Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
R36/38:Irritating to eyes and skin .
Safety Statements 
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
RIDADR  UN 1987
WGK Germany  1
RTECS  RH0795000
Autoignition Temperature 255 - 260 °C
TSCA  Yes
REACH Registrations Active
HS Code  29051620
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Dam. 1
Hazardous Substances Data 123-96-6(Hazardous Substances Data)
Toxicity
LD50 orally in Rabbit: 6100 mg/kg

Hazard Information

Material Safety Data Sheet(MSDS)

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