563-80-4

Name 3-Methyl-2-butanone
CAS 563-80-4
EINECS(EC#) 209-264-3
Molecular Formula C5H10O
MDL Number MFCD00008919
Molecular Weight 86.13
MOL File 563-80-4.mol

Chemical Properties

Appearance MIPK is a colorless liquid with an acetonelike odor.
Melting point  -92 °C (lit.)
Boiling point  94-95 °C (lit.)
density  0.805 g/mL at 25 °C(lit.)
vapor pressure  53.33 hPa (19.9 °C)
refractive index  n20/D 1.388(lit.)
Fp  6 °C
storage temp.  Flammables area
solubility  water: soluble8.21g/L at 20°C
form  Liquid
color  Clear colorless
Odor at 0.10?%?in?dipropylene glycol. camphor
explosive limit 1.5-9%(V)
Odor Threshold 0.5ppm
Water Solubility  6 g/L (20 ºC)
Specific Heat Capacity Cp(liquid):179.9J/(g·K),at 25℃
Merck  14,6090
BRN  1071238
Henry's Law Constant 1.1×10-1 mol/(m3Pa) at 25℃, Brockbank (2013)
Dielectric constant 16.57
Exposure limits TLV-TWA 700 mg/m3 (200 ppm); STEL 875 mg/m3 (250 ppm) (ACGIH).
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C5H10O/c1-4(2)5(3)6/h4H,1-3H3
InChIKey SYBYTAAJFKOIEJ-UHFFFAOYSA-N
SMILES CC(C)C(C)=O
LogP 2.29 at 20℃
CAS DataBase Reference 563-80-4(CAS DataBase Reference)
NIST Chemistry Reference 2-Butanone, 3-methyl-(563-80-4)
EPA Substance Registry System 563-80-4(EPA Substance)

Safety Data

Symbol(GHS)  Flame (GHS02)
GHS02
Signal word  Danger
Hazard statements  H225
Precautionary statements  P210-P233-P240-P241-P242-P243
Hazard Codes  F
Risk Statements 
R11:Highly Flammable.
Safety Statements 
S9:Keep container in a well-ventilated place .
S16:Keep away from sources of ignition-No smoking .
S33:Take precautionary measures against static discharges .
OEB A
OEL TWA: 200 ppm (705 mg/m3)
RIDADR  UN 2397 3/PG 2
WGK Germany  1
RTECS  EL9100000
Autoignition Temperature 475 °C
Hazard Note  Highly Flammable
TSCA  Yes
REACH Registrations Active
HazardClass  3
PackingGroup  II
HS Code  29141990
Storage Class 3 - Flammable liquids
Hazard Classifications Flam. Liq. 2
Safety Profile
Poison by ingestion. Mildly toxic by inhalation and skin contact. Mutation data reported. A skin and eye irritant. Flammable when exposed to heat or flame; can react vigorously with oxidizing materials. When heated to decomposition it emits acrid smoke and irritating fumes.
Hazardous Substances Data 563-80-4(Hazardous Substances Data)
Toxicity
LD50 orally in male mice: 29.86 mmol/kg (Tanii)

Hazard Information

Material Safety Data Sheet(MSDS)

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