5340-36-3

Name 3-METHYL-3-OCTANOL
CAS 5340-36-3
EINECS(EC#) 226-276-4
Molecular Formula C9H20O
MDL Number MFCD00021847
Molecular Weight 144.25
MOL File 5340-36-3.mol
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Chemical Properties

Melting point  6.15°C (estimate)
Boiling point  127 °C (lit.)
density  0.822 g/mL at 25 °C(lit.)
refractive index  n20/D 1.433(lit.)
Fp  163 °F
pka 15.51±0.29(Predicted)
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C9H20O/c1-4-6-7-8-9(3,10)5-2/h10H,4-8H2,1-3H3
InChIKey JEWXYDDSLPIBBO-UHFFFAOYSA-N
SMILES CCCCCC(C)(O)CC
LogP 3.132 (est)
CAS DataBase Reference 5340-36-3(CAS DataBase Reference)
EPA Substance Registry System 3-Octanol, 3-methyl- (5340-36-3)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
WGK Germany  2
RTECS  RH1405000
TSCA  TSCA listed
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Safety Profile
Moderately toxic by ingestion. Low toxicity by skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.

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