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N-Methyldiethanolamine Structure

N-Methyldiethanolamine

  • Product NameN-Methyldiethanolamine
  • CAS105-59-9
  • CBNumberCB3260193
  • MFC5H13NO2
  • MW119.16
  • EINECS203-312-7
  • MDL NumberMFCD00002848
  • MOL File105-59-9.mol

Chemical Properties

Melting point: -21 °C
Boiling point: 246-248 °C(lit.)
Density  1.038 g/mL at 25 °C(lit.)
vapor density  4 (vs air)
vapor pressure  0.01 mm Hg ( 20 °C)
refractive index  n20/D 1.469(lit.)
Flash point: 260 °F
storage temp.  Store below +30°C.
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Liquid
pka 14.41±0.10(Predicted)
color  Clear colorless to light yellow
Odor Ammonical
PH Range 11.5 at 100 g/l at 20 °C
PH 11.5 (100g/l, H2O, 20℃)
explosive limit 0.9-8.4%(V)
Water Solubility  MISCIBLE
BRN  1734441
Henry's Law Constant 3.3×103 mol/(m3Pa) at 25℃, Du et al. (2017)
Stability: Stable. Combustible. Incompatible with strong oxidizing agents.
Cosmetics Ingredients Functions FILM FORMING
InChI 1S/C5H13NO2/c1-6(2-4-7)3-5-8/h7-8H,2-5H2,1H3
InChIKey CRVGTESFCCXCTH-UHFFFAOYSA-N
SMILES N(CCO)(CCO)C
LogP -1.16 at 23℃
Surface tension 33.5 mN/m at 303.15K
CAS DataBase Reference 105-59-9(CAS DataBase Reference)
NIST Chemistry Reference Methyldiethanolamine(105-59-9)
EPA Substance Registry System N-Methyldiethanolamine (105-59-9)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H319
Precautionary statements  P264-P280-P305+P351+P338-P337+P313
Hazard Codes  Xi
Risk Statements  36
Safety Statements  24
RIDADR  2735
WGK Germany  1
RTECS  KL7525000
Autoignition Temperature 770 °F
TSCA  TSCA listed
HS Code  2922 17 00
HazardClass  8
PackingGroup  II
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Irrit. 2
Hazardous Substances Data 105-59-9(Hazardous Substances Data)
Toxicity LD50 orally in Rabbit: 4680 mg/kg
REACH Registrations Active
NFPA 704:
1
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