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1577-22-6

Name 5-HEXENOIC ACID
CAS 1577-22-6
Molecular Formula C6H10O2
MDL Number MFCD00046558
Molecular Weight 114.14
MOL File 1577-22-6.mol
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Chemical Properties

Melting point  -37°C
Boiling point  105 °C/15 mmHg (lit.)
density  0,961 g/cm3
refractive index  1.4340
Fp  107°C/17mm
storage temp.  Sealed in dry,Room Temperature
form  clear liquid
pka 4.76±0.10(Predicted)
color  Colorless to Light yellow
Specific Gravity 0.961
Water Solubility  Insoluble in water.
BRN  1743172
InChI InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h2H,1,3-5H2,(H,7,8)
InChIKey XUDOZULIAWNMIU-UHFFFAOYSA-N
SMILES C(O)(=O)CCCC=C
LogP 1.256 (est)
CAS DataBase Reference 1577-22-6(CAS DataBase Reference)

Safety Data

Hazard Codes  C
Risk Statements 
R34:Causes burns.
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 .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S27:Take off immediately all contaminated clothing .
RIDADR  3265
WGK Germany  3
HazardClass  8
PackingGroup  III
HS Code  29161900

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