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Basic information

  • Name:
  • 4-Bromo-1-butene

  • CAS No.:
  • 5162-44-7

  • Molecular Structure:
  • Formula:
  • C4H7Br
  • Molecular Weight:
  • 135.01 .
  • Synonyms:
  • 1-Bromo-3-butene;3-Butenyl bromide;4-Bromobutene-1;Allylcarbinyl bromide;Homoallyl bromide;
  • EINECS:
  • 225-937-4
  • Density:
  • 1.312 g/cm3
  • Boiling Point:
  • 99.3 °C at 760 mmHg
  • Flash Point:
  • 9.4 °C
  • Appearance:
  • colourless liquid
  • Hazard Symbols:
  • FlammableF, HarmfulXn, IrritantXi
  • Risk Codes:
  • 11-36/37-42/43
  • Safety Description:
  • 26-36/37/39 Details
  • Transport Information:
  • UN 1993 3/PG 2

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Chemistry

Product Name: 4-Bromo-1-butene (CAS NO.5162-44-7)

Molecular formula: C4H7Br
Molecular Weight: 135 
EINECS: 225-937-4
Boiling point: 98-100 °C(lit.)
Flash point: 49 °F
Density: 1.33 g/mL at 25 °C(lit.)
Refractive index: n20/D 1.462(lit.)
Storage temp.: 2-8°C
Sensitive: Light Sensitive
Index of Refraction: 1.457 
Molar Refractivity: 28.03 cm3 
Molar Volume: 102.8 cm
XLogP3-AA: 2.1
H-Bond Donor: 0
H-Bond Acceptor: 0
Structure Descriptors of 4-Bromo-1-butene (CAS NO.5162-44-7):
  IUPAC Name: 4-bromobut-1-ene
  Canonical SMILES: C=CCCBr
  InChI: InChI=1S/C4H7Br/c1-2-3-4-5/h2H,1,3-4H2 
  InChIKey: DMAYBPBPEUFIHJ-UHFFFAOYSA-N
Product Categories: Halides; omega-Functional Alkanols, Carboxylic Acids, Amines & Halides; omega-Unsaturated Halides; Alkenyl; Halogenated Hydrocarbons; Organic Building Blocks

Uses

 4-Bromo-1-butene (CAS NO.5162-44-7) is used for drug intermediates.

Consensus Reports

 4-Bromo-1-butene (CAS NO.5162-44-7) is reported in EPA TSCA Inventory.

Safety Profile

Safety Information of 4-Bromo-1-butene (CAS NO.5162-44-7):
Hazard Codes:  FFlammable, XnHarmful,XiIrritantXi
Risk Statements information:
11:  Highly Flammable 
36/37:  Irritating to eyes and respiratory system 
42/43:  May cause sensitization by inhalation and skin contact  
Safety Statements information:
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36/37/39:  Wear suitable protective clothing, gloves and eye/face protection 
F: 8-19
HazardClass: 3
PackingGroup: II
HS Code: 29033036
RIDADR: UN 1993 3/PG 2
WGK Germany: 3
A dangerous fire hazard (flash point <1°C). Violent reaction with chloromethylphenylsilane + chloroplatinic acid. When heated to decomposition it emits toxic fumes of Br.

Specification

 4-Bromo-1-butene , its CAS NO. is 5162-44-7, the synonyms are 4-bromobut-1-ene ; 4-Bromobutene ; 4-Bromobutene-(1) ; Homoallyl bromide ; 4-bromo-1-buten ; 4-bromo-but-1-ene ; 1-Bromo-3-butene;1-butene,4-bromo- .

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