1,1,1-Tris(hydroxymethyl)ethane Structure

1,1,1-Tris(hydroxymethyl)ethane

Chemical Properties

Melting point 193-195 °C(lit.)
Boiling point 137°C 15mm
Density  1.0456 (rough estimate)
refractive index  1.4056 (estimate)
Flash point 160°C
storage temp.  Inert atmosphere,Room Temperature
pka 14.03±0.10(Predicted)
form  Crystalline Powder, Crystals, and/or Chunks
color  White
Water Solubility  soluble
Sensitive  Hygroscopic
BRN  1304452
Henry's Law Constant 9.0×102 mol/(m3Pa) at 25℃, HSDB (2015)
InChI 1S/C5H12O3/c1-5(2-6,3-7)4-8/h6-8H,2-4H2,1H3
InChIKey QXJQHYBHAIHNGG-UHFFFAOYSA-N
SMILES CC(CO)(CO)CO
CAS DataBase Reference 77-85-0(CAS DataBase Reference)
Indirect Additives used in Food Contact Substances TRIMETHYLOLETHANE
FDA 21 CFR 175.300; 175.320; 176.180;176.210; 177.1390; 177.2420;178.3725
FDA UNII 5D10NYN23W
NIST Chemistry Reference 1,3-Propanediol, 2-(hydroxymethyl)-2-methyl-(77-85-0)
EPA Substance Registry System 1,3-Propanediol, 2-(hydroxymethyl)-2-methyl- (77-85-0)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302-H315-H319-H335
Precautionary statements P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety Statements  22-24/25
WGK Germany  3
RTECS  TY7137500
F  3
TSCA  TSCA listed
HS Code  29054910
Storage Class 11 - Combustible Solids
Hazardous Substances Data 77-85-0(Hazardous Substances Data)
NFPA 704:
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