1-Bromo-3,3,3-trifluoroprop-1-ene

Base Information

• Chemical Name: 1-Bromo-3,3,3-trifluoroprop-1-ene
• CAS No.: 149597-47-7
• Molecular Formula: C3H2 Br F3
• Molecular Weight: 174.948
• Hs Code.: 2903793090
• European Community (EC) Number: 689-888-4
• DSSTox Substance ID: DTXSID9075248
• Nikkaji Number: J1.254.470G
• Mol file: 149597-47-7.mol

Synonyms:1-bromo-3,3,3-trifluoroprop-1-ene;149597-47-7;460-33-3;(E)-1-bromo-3,3,3-trifluoroprop-1-ene;1-Propene, 1-bromo-3,3,3-trifluoro-;1-Propene, 1-bromo-3,3,3-trifluoro-, (1E)-;DTXSID9075248;MFCD01862034;1-bromo-3,3,3-trifluoro-1-propene;AKOS005063440;AKOS025310195;(E-)-1-bromo-3,3,3-trifluoroprop-1-ene;E-1-BROMO-3,3,3-TRIFLUOROPROPENE-1

Chemical Property of 1-Bromo-3,3,3-trifluoroprop-1-ene

Chemical Property:

• Vapor Pressure: 69.3mmHg at 25°C
• Refractive Index: 1.393
• Boiling Point: 88.3°Cat760mmHg
• Flash Point: °C
• PSA: 0.00000
• Density: 1.728g/cm³
• LogP: 2.45730
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 173.92920
• Heavy Atom Count: 7
• Complexity: 72.7

Purity/Quality:

97% ^*data from raw suppliers

(E)-1-Bromo-3,3,3-trifluoropropene-1 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(=CBr)C(F)(F)F
• Isomeric SMILES: C(=C/Br)\C(F)(F)F
• Uses: (E)-1-Bromo-3,3,3-trifluoropropene-1 is used in of 3,3,3-Trifluoropropyne via gas-phase isomerization of 1-Halogeno-3,3,3-trifluoropropene and Dehydrohalogenation.