1020-31-1

Name 3,5-Di-tert-butylcatechol
CAS 1020-31-1
EINECS(EC#) 213-816-9
Molecular Formula C14H22O2
MDL Number MFCD00008819
Molecular Weight 222.32
MOL File 1020-31-1.mol

Chemical Properties

Appearance white to pale brown solid
Melting point  95-100 °C(lit.)
Boiling point  145 °C / 5mmHg
density  1.0200 (rough estimate)
refractive index  1.4576 (estimate)
storage temp.  Inert atmosphere,Room Temperature
form  Solid
pka 10.04±0.15(Predicted)
color  White to pale brown
Stability: Stable. Combustible. Incompatible with strong oxidizing agents.
Water Solubility  Insoluble in water.
BRN  1370212
InChI InChI=1S/C14H22O2/c1-13(2,3)9-7-10(14(4,5)6)12(16)11(15)8-9/h7-8,15-16H,1-6H3
InChIKey PJZLSMMERMMQBJ-UHFFFAOYSA-N
SMILES C1(O)=CC(C(C)(C)C)=CC(C(C)(C)C)=C1O
CAS DataBase Reference 1020-31-1(CAS DataBase Reference)
NIST Chemistry Reference 1,2-Benzenediol, 3,5-bis(1,1-dimethylethyl)-(1020-31-1)
EPA Substance Registry System 1020-31-1(EPA Substance)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
WGK Germany  3
F  10-23
TSCA  Yes
HS Code  29072900
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Hazard Information

Material Safety Data Sheet(MSDS)

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