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1,3-Dibromobutane

1,3-Dibromobutane structure

CAS No:
107-80-2
Formula:
C4H8Br2
Chemical Name:
1,3-Dibromobutane
Synonyms:
Butane,1,3-dibromo-;1,3-Dibromobutane;(±)-1,3-Dibromobutane;79390-67-3
Categories:
Chemical Reagents > Organic Reagents

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Description

Clear colourless liquid

1,3-Dibromobutane Basic Attributes

Molecular Weight：

215.916

Exact Mass：

215.91

EC Number：

203-520-8

HScode：

29033036

Characteristics

PSA：

XLogP3：

2.90

Appearance：

Clear, colorless liquid.

Density：

1.7904 g/cm³ @ Temp: 20 °C

Melting Point：

-25.98°C (estimate)

Boiling Point：

174 °C

Flash Point：

173-176°C

Refractive Index：

n 20/D 1.5080(lit.)

Water Solubility：

INSOLUBLE

Storage Conditions：

Store in a cool, dry place. Store in a tightly closed container.

Vapor Pressure：

1.65mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

2810

wgk germany：

hazard class code：

R36/38

safety instructions：

26-36-37/39

Marks：

Xi,C

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 45 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1,3-Dibromobutane Use and Manufacturing

Manufacturing Info：

Butane, 1,3-dibromo-: ACTIVE

Computed Properties

Molecular Weight:215.91
XLogP3:2.5
Rotatable Bond Count:2
Exact Mass:215.89723
Monoisotopic Mass:213.89928
Heavy Atom Count:6
Complexity:28.7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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