6033-23-4

Name (S)-(+)-2-Heptanol
CAS 6033-23-4
Molecular Formula C7H16O
MDL Number MFCD00065003
Molecular Weight 116.2
MOL File 6033-23-4.mol
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Chemical Properties

Appearance Colorless to light yellow liqui
Melting point  -30.45°C (estimate)
alpha  9.5 º (NEAT)
Boiling point  149-150 °C (lit.)
density  0.815 g/mL at 25 °C(lit.)
vapor density  4 (vs air)
vapor pressure  1 mm Hg ( 15 °C)
refractive index  n20/D 1.421(lit.)
Fp  148 °F
storage temp.  Store at room temperature
form  Liquid
pka 15.44±0.20(Predicted)
Specific Gravity 0.815
Odor at 1.00 % in dipropylene glycol. mushroom oily fatty blue cheese moldy
Odor Type mushroom
Optical Rotation [α]24/D +10°, neat
Water Solubility  Soluble in water(3569 mg/L at 25°C).
InChI 1S/C7H16O/c1-3-4-5-6-7(2)8/h7-8H,3-6H2,1-2H3/t7-/m0/s1
InChIKey CETWDUZRCINIHU-ZETCQYMHSA-N
SMILES CCCCC[C@H](C)O
LogP 2.211 (est)
CAS DataBase Reference 6033-23-4(CAS DataBase Reference)
NIST Chemistry Reference 2-Heptanol, (S)-(6033-23-4)
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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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
RIDADR  UN1987
WGK Germany  3
HazardClass  3
PackingGroup  III
HS Code  2905190098
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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