868-57-5

Name Methyl 2-methylbutyrate
CAS 868-57-5
EINECS(EC#) 212-778-0
Molecular Formula C6H12O2
MDL Number MFCD00009335
Molecular Weight 116.16
MOL File 868-57-5.mol

Chemical Properties

Melting point  -91°C (estimate)
Boiling point  115 °C (lit.)
density  0.88 g/mL at 25 °C(lit.)
FEMA  2719
refractive index  n20/D 1.393(lit.)
Fp  90 °F
storage temp.  Sealed in dry,Room Temperature
solubility  Very slightly soluble in water, soluble in alcohol and oils.
form  Liquid
color  Colorless to Almost colorless
Odor at 10.00 % in dipropylene glycol. ethereal estery fruity tutti frutti green apple lily of the valley powdery fatty
biological source synthetic
Odor Type fruity
JECFA Number 205
BRN  1720409
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C6H12O2/c1-4-5(2)6(7)8-3/h5H,4H2,1-3H3
InChIKey OCWLYWIFNDCWRZ-UHFFFAOYSA-N
SMILES CCC(C)C(=O)OC
LogP 1.59
CAS DataBase Reference 868-57-5(CAS DataBase Reference)
NIST Chemistry Reference Butanoic acid, 2-methyl-, methyl ester(868-57-5)
EPA Substance Registry System 868-57-5(EPA Substance)

Safety Data

Symbol(GHS)  Flame (GHS02)
GHS02
Signal word  Warning
Hazard statements  H226
Precautionary statements  P210-P233-P240-P241-P242-P243
Risk Statements 
R10:Flammable.
R11:Highly Flammable.
Safety Statements 
S16:Keep away from sources of ignition-No smoking .
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S33:Take precautionary measures against static discharges .
RIDADR  UN 3272 3/PG 3
WGK Germany  2
TSCA  Yes
HazardClass  3
PackingGroup  II
HS Code  29159000
Storage Class 3 - Flammable liquids
Hazard Classifications Flam. Liq. 3

Raw materials And Preparation Products

Hazard Information

Material Safety Data Sheet(MSDS)

Well-known Reagent Company Product Information

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