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581-42-0

581-42-0 structural image
Product Name: 2,6-DIMETHYLNAPHTHALENE
Formula: C12H12
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description White powder; [Alfa Aesar MSDS]
Collision Cross Section 126.3 Ų [M*]+ 128.6 Ų [M+H]+
Kovats Retention Index 1381.69 1381.93 1382 1377 1400 1400 1401 1408 1402 1403 1387 1399 1377 1395.6 1408.8 1388 1403 1382 1367.7 1383.5 1384.5 1384 1388 1388 1389 1396 1388.3 1388 1400 237.6 239.7
Chemical Classes Other Classes -> Naphthalenes

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Environment
GHS09
GHS Hazard Statements H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 156.22 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 0
Exact Mass 156.093900383 g/mol
Monoisotopic Mass 156.093900383 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 132
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

2,6-dimethylnaphthalene is a dimethylnaphthalene carrying methyl groups at positions 2 and 6. It has a role as an environmental contaminant.