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2-Butyloxirane

2-Butyloxirane structure

CAS No:
1436-34-6
Formula:
C6H12O
Chemical Name:
2-Butyloxirane
Synonyms:
Oxirane,2-butyl-;Hexane,1,2-epoxy-;Oxirane,butyl-;2-Butyloxirane;1,2-Hexene oxide;1,2-Epoxyhexane;1-Hexene epoxide;1-Hexene oxide;Butyloxirane;(±)-1,2-Epoxyhexane;(±)-Butyloxirane;NSC 24268;122922-40-1;56158-38-4
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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Description

clear colorless liquid

2-Butyloxirane Basic Attributes

Molecular Weight：

100.16

Exact Mass：

100.16

BRN：

102568

EC Number：

215-864-6

NSC Number：

246211|24268

HScode：

29109000

Characteristics

PSA：

12.5

XLogP3：

1.57540

Appearance：

Clear colorless Liquid

Density：

0.8456 g/cm³ @ Temp: 19.5 °C

Melting Point：

93-95 °C

Boiling Point：

109-110 °C

Flash Point：

60 °F

Refractive Index：

n 20/D 1.406

Water Solubility：

Difficult to mix.

Storage Conditions：

2-8°C

Vapor Pressure：

21.1mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 1993 3/PG 2

wgk germany：

hazard class code：

11-22-36/37/38

safety instructions：

RTECS Number：

MO3630000

Marks：

F,Xn

Precautionary statement(s)：

P210-P261-P305 + P351 + P338

Hazard Statements：

H225-H302-H315-H319-H335

GHS Classification：

|Danger|H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Warning|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P261, P264, P270, P271, P281, P301+P312, P304+P312, P304+P340, P308+P313, P312, P330, P405, and P501

Drug Information

MeSH Entry Terms：

1,2-epoxyhexane

Computed Properties

Molecular Weight:100.16
XLogP3:1.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:100.088815002
Monoisotopic Mass:100.088815002
Topological Polar Surface Area:12.5
Heavy Atom Count:7
Complexity:52.1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

1-Hexene

Acetonitrile

m-Chloroperbenzoic acid

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