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3,3-Dimethyl-1-butene

3,3-Dimethyl-1-butene structure

CAS No:
558-37-2
Formula:
C6H12
Chemical Name:
3,3-Dimethyl-1-butene
Synonyms:
1-Butene,3,3-dimethyl-;3,3-Dimethyl-1-butene;3,3-Dimethylbutene;Neohexene;tert-Butylethylene;tert-Hexene;Trimethylvinylmethane;2,2-Dimethyl-3-butene;tert-Butylethene;NSC 74119;11069-54-8
Categories:
Chemical Reagents > Organic Reagents

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Description

clear colorless liquid

3,3-Dimethyl-1-butene Basic Attributes

Molecular Weight：

84.16

Exact Mass：

84.16

BRN：

1697101

EC Number：

209-195-9

UNII：

01ZB73D2KK

NSC Number：

74119

DSSTox ID：

DTXSID1027211

HScode：

29012980

Characteristics

PSA：

XLogP3：

2.21850

Appearance：

Clear colorless Liquid

Density：

0.6549 g/cm³ @ Temp: 18 °C

Melting Point：

-115.2 °C

Boiling Point：

41.2 °C

Flash Point：

−20 °F

Refractive Index：

n20/D 1.376(lit.)

Water Solubility：

Not miscible or difficult to mix in water.

Storage Conditions：

Flammables area

Vapor Pressure：

6.96 psi ( 20 °C)

Vapor Density：

>1 (vs air)

Explosive limit：

1.2%(V)

OH：

2.84e-11 cm3/molecule*sec

Safety Information

Packing level：

Hazard category：

Transport codes：

UN 3295 3/PG 2

wgk germany：

hazard class code：

11-36/37/38-65

safety instructions：

16-26-33-36-62-37/39

RTECS Number：

BS8000000

Marks：

F,Xn,Xi

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P301+P310, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P331, 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, P301+P310, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P331, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 69 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

3,3-Dimethyl-1-butene Use and Manufacturing

Manufacturing Info：

1-Butene, 3,3-dimethyl-: ACTIVE

Computed Properties

Molecular Weight:84.16
XLogP3:2.7
Rotatable Bond Count:1
Exact Mass:84.093900383
Monoisotopic Mass:84.093900383
Heavy Atom Count:6
Complexity:45.5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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