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2,2,4-TRIMETHYLHEXANE

2,2,4-TRIMETHYLHEXANE structure

CAS No:
16747-25-4
Formula:
C9H20
Chemical Name:
2,2,4-TRIMETHYLHEXANE
Synonyms:
2,2,4-TRIMETHYLHEXANE;Hexane, 2,2,3-trimethyl-;2,2,3-TRIMETHYLHEXANE

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2,2,4-TRIMETHYLHEXANE Basic Attributes

Molecular Weight：

128.26

Exact Mass：

128.26

EC Number：

240-806-1

DSSTox ID：

DTXSID20274842

Characteristics

PSA：

0 Å²

Density：

0.716 g/mL at 20 °C(lit.)

Melting Point：

-119.99°C

Boiling Point：

125-127 °C(lit.)

Refractive Index：

n20/D1.403

Water Solubility：

362.3ug/L(temperature not stated)

Henrys Law Constant：

1.5×10-6mol/(m3Pa) at 25℃, Yaws (2003)

Safety Information

wgk germany：

hazard class code：

safety instructions：

Hazard Statements：

RIDADR：

UN 3295 3/PG 2

Computed Properties

Molecular Weight:128.25
XLogP3:4.4
Rotatable Bond Count:3
Exact Mass:128.156500638
Monoisotopic Mass:128.156500638
Heavy Atom Count:9
Complexity:66.6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,2,4-TRIMETHYLHEXANE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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