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2-Butene-1,4-diol Structure

2-Butene-1,4-diol

Chemical Properties

Melting point 4-10 °C(lit.)
Boiling point 235 °C(lit.)
Density  1.07 g/mL at 25 °C(lit.)
refractive index  n20/D 1.479
Flash point >230 °F
solubility  Chloroform (Soluble), DMSO (Slightly)
form  Oil
pka 14.17±0.10(Predicted)
color  yellow
InChI InChI=1S/C4H8O2/c5-3-1-2-4-6/h1-2,5-6H,3-4H2
InChIKey ORTVZLZNOYNASJ-UHFFFAOYSA-N
SMILES C(O)C=CCO
CAS DataBase Reference 110-64-5(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII 2I323Z5567
NIST Chemistry Reference 2-Butene-1,4-diol(110-64-5)
EPA Substance Registry System 2-Butene-1,4-diol (110-64-5)

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H302-H319-H315-H335
Precautionary statements P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes  Xn
Risk Statements  22-36/37/38
Safety Statements  23-24/25-36-26
WGK Germany  3
RTECS  EM4970000
F  23
HS Code  29053990
Hazardous Substances Data 110-64-5(Hazardous Substances Data)
NFPA 704:
1
1 0

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