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13706-86-0

Basic Information
CAS No.: 13706-86-0
Name: 5-METHYL-2,3-HEXANEDIONE
Molecular Structure:
Molecular Structure of 13706-86-0 (5-METHYL-2,3-HEXANEDIONE)
Formula: C7H12 O2
Molecular Weight: 128.171
Synonyms: 2-Methylhexa-4,5-dione;5-methyl-2,3-hexanedione
EINECS: 237-241-8
Density: 0,92 g/cm3
Melting Point: 26.25°C (estimate)
Boiling Point: 138 °C at 760 mmHg
Flash Point: 33°C
Risk Codes: 10
Safety: A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.
PSA: 34.14000
LogP: 1.19060
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Chemistry

IUPAC Name: 5-methylhexane-2,3-dione
Synonyms:5-Methyl-3-hexanedione ; Acetylisopentanoyl ; Fema 3190 ; 5-Methyl-2,3-hexanedione ; Acetylisovaleryl ; Methylhexanedione ; 5-Methylhexane-2,3-dione ; Isovaleryl acetate
CAS NO: 13706-86-0
Molecular Formula of 5-Methyl-2,3-hexanedione (CAS NO. 13706-86-0) : C7H12O2
Molecular Weight of 5-Methyl-2,3-hexanedione (CAS NO. 13706-86-0) :128.17
Molecular Structure of of 5-Methyl-2,3-hexanedione (CAS NO. 13706-86-0) :
EINECS: 237-241-8
Mol File: 13706-86-0.mol
Index of Refraction: 1.411
Surface Tension: 27.6 dyne/cm
Density: 0.924 g/cm3
Flash Point: 41.7 °C
Enthalpy of Vaporization: 37.53 kJ/mol
Boiling Point: 138 °C at 760 mmHg
Vapour Pressure: 6.87 mmHg at 25°C
FEMA : 3190

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 20, Pg. 637, 1982.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 20, Pg. 637, 1982.

 

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Risk Statements 10
R10:Flammable.
Safety Statements 16 
S16:Keep away from sources of ignition.
RIDADR 1224
RTECS MO3200000