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2,4-PENTANEDIOL Structure

2,4-PENTANEDIOL

Chemical Properties

Melting point 52.5°C
Boiling point 201-202 °C (lit.)
Density  0.95 g/mL at 25 °C (lit.)
refractive index  n20/D 1.435(lit.)
Flash point 215 °F
storage temp.  Store below +30°C.
solubility  Fully miscible.
form  clear liquid
pka 14.74±0.20(Predicted)
color  Syrup
Sensitive  Hygroscopic
BRN  969186
InChI InChI=1S/C5H12O2/c1-4(6)3-5(2)7/h4-7H,3H2,1-2H3
InChIKey GTCCGKPBSJZVRZ-UHFFFAOYSA-N
SMILES CC(O)CC(O)C
LogP -0.386 (est)
CAS DataBase Reference 625-69-4(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII 92H536ZDXF
UNSPSC Code 12352100
NACRES NA.22
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Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P271-P280
Safety Statements  24/25
WGK Germany  2
RTECS  SA0490000
HS Code  2905399590
Toxicity LD50 orl-rat: 6860 mg/kg AMIHBC 10,61,54
NFPA 704:
0
0 1

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