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702-79-4

702-79-4 structural image
Product Name: 1,3-Dimethyladamantane
Formula: C12H20
Synonyms: 1,3-Dimethyladamantane;1,3-Dimethyltricyclo[3.3.1.13,7]decane
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1184 1130 1151 1163 1174 1184 1151 1151

SAFETY INFORMATION

Signal word Warning
Pictogram(s)
GHS02
Flame
Flammables
GHS02
GHS Hazard Statements H226:Flammable liquids
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P233:Keep container tightly closed.
P240:Ground/bond container and receiving equipment.
P241:Use explosion-proof electrical/ventilating/lighting/…/equipment.
P242:Use only non-sparking tools.
P243:Take precautionary measures against static discharge.

COMPUTED DESCRIPTORS

Molecular Weight 164.29 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 0
Exact Mass 164.156500638 g/mol
Monoisotopic Mass 164.156500638 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 182
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-dimethyladamantane is a polycyclic alkane and a member of adamantanes. It derives from a hydride of an adamantane.