tert-Amylbenzene  Structure

tert-Amylbenzene

Chemical Properties

Melting point -44.72°C (estimate)
Boiling point 188-191°C
Density  0,87 g/cm3
refractive index  1.4960
Flash point 65°C
storage temp.  Sealed in dry,Room Temperature
form  liquid
color  Colorless to Light yellow
Water Solubility  10.5mg/L(25 ºC)
BRN  2039053
Henry's Law Constant 5.4×10-4 mol/(m3Pa) at 25℃, Hine and Mookerjee (1975)
Major Application battery manufacturing
InChI InChI=1S/C11H16/c1-4-11(2,3)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3
InChIKey QHTJSSMHBLGUHV-UHFFFAOYSA-N
SMILES C1(C(C)(C)CC)=CC=CC=C1
CAS DataBase Reference 2049-95-8(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII ER8C1TON3X
NIST Chemistry Reference 2-Phenyl-2-methyl butane(2049-95-8)
EPA Substance Registry System tert-Amylbenzene (2049-95-8)
UNSPSC Code 26111700

Safety

Symbol(GHS) Flame (GHS02)Exclamation Mark (GHS07)Environment (GHS09)
Signal wordWarning
Hazard statements H226-H317-H411
Precautionary statements P210-P273-P280-P302+P352
Safety Statements  23-24/25
RIDADR  UN1993 - class 3 - PG 3 - EHS - Flammable liquids, n.o.s., HI: all
WGK Germany  WGK 3
RTECS  DA6720000
TSCA  TSCA listed
HazardClass  3
PackingGroup  III
HS Code  29029090
Storage Class 3 - Flammable liquids
Hazard Classifications Aquatic Chronic 2
Flam. Liq. 3
Skin Sens. 1
Toxicity LDLo orl-rat: 10 mL/kg AMIHAB 19,403,59
NFPA 704:
2
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