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Phenylacetic acid isobutyl ester Structure

Phenylacetic acid isobutyl ester

Chemical Properties

Boiling point 253 °C(lit.)
Density  0.986 g/mL at 25 °C(lit.)
vapor pressure  2-3.4Pa at 20-25℃
FEMA  2210 | ISOBUTYL PHENYLACETATE
refractive index  n20/D 1.487(lit.)
Flash point >230 °F
form  Liquid
Specific Gravity 0.985~0.991 (20/4℃)
color  Colorless to Light yellow
Odor at 100.00 %. sweet floral honey chocolate amber
Odor Type chocolate
JECFA Number 1013
LogP 3.5 at 35℃ and pH7
Substances Added to Food (formerly EAFUS) ISOBUTYL PHENYLACETATE
FDA 21 CFR 172.515
CAS DataBase Reference 102-13-6(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII 2QK898564G
NIST Chemistry Reference Iso-butyl-phenyl-acetate(102-13-6)
EPA Substance Registry System Benzeneacetic acid, 2-methylpropyl ester (102-13-6)

Safety

Symbol(GHS)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  2
RTECS  CY1681950
TSCA  Yes
HS Code  29163990
Toxicity Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg.
NFPA 704:
1
0 0

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