1002-36-4

Name 2-Heptyn-1-ol
CAS 1002-36-4
Molecular Formula C7H12O
MDL Number MFCD00039541
Molecular Weight 112.17
MOL File 1002-36-4.mol
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Chemical Properties

Appearance Clear colorless to yellow liquid
Melting point  -35.25°C (estimate)
Boiling point  89-90 °C/16 mmHg (lit.)
density  0.880 g/mL at 25 °C(lit.)
refractive index  n20/D 1.455(lit.)
Fp  172 °F
storage temp.  2-8°C
form  Liquid
pka 13.02±0.10(Predicted)
color  Clear colorless to yellow
BRN  1739001
InChI InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h8H,2-4,7H2,1H3
InChIKey OGDYROFIIXDTQK-UHFFFAOYSA-N
SMILES C(O)C#CCCCC
CAS DataBase Reference 1002-36-4(CAS DataBase Reference)
EPA Substance Registry System 2-Heptyn-1-ol (1002-36-4)

Safety Data

Hazard Codes  Xi,Xn
Risk Statements 
R43:May cause sensitization by skin contact.
R36/37/38:Irritating to eyes, respiratory system and skin .
R22:Harmful if swallowed.
Safety Statements 
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
RIDADR  1987
WGK Germany  3
HazardClass  CBL
HS Code  29052900
Storage Class 10 - Combustible liquids
Hazard Classifications Aquatic Chronic 2
Resp. Sens. 1

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