126-30-7

Name 2,2-Dimethyl-1,3-propanediol
CAS 126-30-7
EINECS(EC#) 204-781-0
Molecular Formula C5H12O2
MDL Number MFCD00004685
Molecular Weight 104.15
MOL File 126-30-7.mol

Chemical Properties

Appearance white solid
Melting point  126-128 °C
Boiling point  208 °C
density  1.06
vapor density  3.6 (vs air)
vapor pressure  <0.8 mm Hg ( 20 °C)
refractive index  1.4406 (estimate)
Fp  107 °C
storage temp.  Inert atmosphere,Room Temperature
solubility  830g/l
form  Crystalline Chunks
pka 14.57±0.10(Predicted)
color  White
Stability: Stable. Incompatible with strong oxidizing agents, acetic anhydride, acid chlorides, moisture. Combustible.
explosive limit 1.34%, 149°F
Water Solubility  830 g/L (20 ºC)
Sensitive  Hygroscopic
Merck  14,6458
BRN  605291
Henry's Law Constant 4.0×102 mol/(m3Pa) at 25℃, Wang et al. (2017)
Cosmetics Ingredients Functions SOLVENT
PLASTICISER
InChI 1S/C5H12O2/c1-5(2,3-6)4-7/h6-7H,3-4H2,1-2H3
InChIKey SLCVBVWXLSEKPL-UHFFFAOYSA-N
SMILES CC(C)(CO)CO
LogP -0.15 at 25℃
CAS DataBase Reference 126-30-7(CAS DataBase Reference)
NIST Chemistry Reference 1,3-Propanediol, 2,2-dimethyl-(126-30-7)
EPA Substance Registry System 126-30-7(EPA Substance)

Safety Data

Symbol(GHS)  Corrosion (GHS05)
GHS05
Signal word  Danger
Hazard statements  H318
Precautionary statements  P280-P305+P351+P338
Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
R36:Irritating to the eyes.
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S39:Wear eye/face protection .
WGK Germany  1
RTECS  TY5775000
F  3
Autoignition Temperature 750 °F
TSCA  Yes
REACH Registrations Active
HS Code  29053900
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Dam. 1
Hazardous Substances Data 126-30-7(Hazardous Substances Data)
Toxicity
rat,LCLo,inhalation,39000ppm/6H (39000ppm),Kodak Company Reports. Vol. 21MAY1971,

Hazard Information

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