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2,3,3-Trimethyl-1-butene

2,3,3-Trimethyl-1-butene structure

CAS No:
594-56-9
Formula:
C7H14
Chemical Name:
2,3,3-Trimethyl-1-butene
Synonyms:
1-Butene,2,3,3-trimethyl-;2,3,3-Trimethyl-1-butene;Triptene;1-Methyl-1-tert-butylethylene;2,3,3-Trimethylbutene;2-tert-Butylpropene;1-Methyl-1-tert-butylethene;1-tert-Butyl-1-methylethylene;2,2,3-Trimethylbutene;NSC 73922
Categories:
Chemical Reagents > Organic Reagents

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Description

CLEAR COLOURLESS LIQUID

2,3,3-Trimethyl-1-butene Basic Attributes

Molecular Weight：

98.19

Exact Mass：

98.19

EC Number：

209-845-1

NSC Number：

73922

DSSTox ID：

DTXSID80208123

HScode：

29012900

Characteristics

PSA：

XLogP3：

2.60860

Appearance：

Clear colorless Liquid

Density：

0.7235 g/cm³ @ Temp: 40 °C

Melting Point：

-109.9 °C

Boiling Point：

77.9 °C

Flash Point：

1 °F

Refractive Index：

n20/D 1.402(lit.)

Storage Conditions：

Flammables area

Vapor Pressure：

190 mm Hg ( 37.7 °C)

Vapor Density：

3.39 (vs air)

Safety Information

Packing level：

Hazard category：

3.1

Transport codes：

UN 3295 3/PG 2

wgk germany：

hazard class code：

11-36/37/38

safety instructions：

16-26-36/37/39

Marks：

F,Xi

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, P501

Hazard Statements：

H225

GHS Classification：

|Danger|H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:98.19
XLogP3:3.4
Rotatable Bond Count:1
Exact Mass:98.109550447
Monoisotopic Mass:98.109550447
Heavy Atom Count:7
Complexity:72.5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes