Basic information
- CAS
6974-12-5- Standard SMILES
BrCC=CCBr- InChIKey
RMXLHIUHKIVPAB-UHFFFAOYSA-N- Molecular formula
- C4H6Br2
- Average molar mass
- 213.9 g/mol
- Monoisotopic mass
- 211.88362439
Names & identifiers
- Preferred name
- 2-Butene, 1,4-dibromo-
- IUPAC
- 1,4-dibromobut-2-ene
- English name
- trans-1,4-Dibromo-2-butene
- Molecular formula
- C4H6Br2
- Molecular weight
- 213.9
Names & synonyms
1,4-Dibromobut-2-ene2-BUTENE, 1,4-DIBROMO-cis-1,4-dibromo-2-butene30794-77-51.4-dibromobut-2-ene1,2-dibromomethylethylene1,4-dibromo-but-2-eneSCHEMBL137154DTXSID90859544RMXLHIUHKIVPAB-UHFFFAOYSA-NAKOS025243577NS00077544
Show more names
1,4-DIBROMO-2-BUTENEtl80TL 80Nsc23187Wln: E2U2e1,4-dibromo-2-butenCis-1,4-DibromoButeneRANS-1,4-DIBROMO-2-BUTENE
F358041
Database identifiers
- CAS
6974-12-5- PubChem CID
- 13180
- DTXSID
DTXSID90859544- EC Number
- 230-219-9
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 34.8
Physicochemical properties
- Melting point
- 48 · 48-51 °C(lit.)
- Boiling point
- 205 °C · 205 °C(lit.)
- Density
- 1.9393 · 1.9393 (estimate)
- refractive index
- 1.543 · 1.5430 (estimate)
- Flash point
- 113 °C · 113 °C
- storage temp.
- 2 · Sealed in dry,2-8°C
- color
- colorless to slightly brown
- CAS DataBase Reference
- 6974 · 6974-12-5(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- Hazard Codes
- T
- Risk Statements
- 25 · 25-34
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 2923 · UN 2923 8/PG 2
- WGK Germany
- 2 · 2
- RTECS
- 4725000 · EM4725000
- F
- 8 · 8-19
Safety & regulation
Safety data
- F
- 8-19
- wgk
- 2
- rtecs
- EM4725000
- ridadr
- UN 2923 8/PG 2
- risk_code
- 25-34
- hazard_code
- T
- safety_code
- 26-36/37/39-45
Chemistry & industry
Applications
UsesTrans-1,4-dibromo-2-butene can be used as an organic synthesis intermediate.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers51 total
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
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Mainchem Co., Ltd.+86-86-05926210733 · [email protected]
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Related reactions
88 records
Compound notes
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