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99-62-7

99-62-7 structural image
Product Name: 1,3-DIISOPROPYLBENZENE
Formula: C12H18
Synonyms: 3-Isopropylcumene
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid
Color/Form COLORLESS LIQ
Boiling Point 203.2 °C @ 760 MM HG
Melting Point -61 °C
Solubility INSOL IN WATER
Density 0.8559 @ 20 °C/4 °C
Vapor Pressure 0.39 [mmHg]
LogP 4.50
Autoignition Temperature 840 °F.
Kovats Retention Index 1136.2 1141 1139 1142.75 1141 1141 1143 1143 1147 1151 1139 1142.7 1146.8 1150.7 1135.2 1141 1153.4 1142 1143 1143 1147 1147 1135
Chemical Classes Solvents -> Aromatic Solvents

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H227:Flammable liquids
H315:Skin corrosion/irritation
H320:Serious eye damage/eye irritation
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P391:Collect spillage. Hazardous to the aquatic environment
P370+P378:In case of fire: Use … for extinction.
P403+P235:Store in a well-ventilated place. Keep cool.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 162.27 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 2
Exact Mass 162.140850574 g/mol
Monoisotopic Mass 162.140850574 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 110
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

1,3-Diisopropylbenzene is an alkylbenzene.