Perfluorohexyl bromide

• CAS: 335-56-8
• Catalog Number: ACM335568
• Category: Alkyl
• Molecular Weight: 398.95
• Molecular Formula: C₆BrF₁₃
• Synonyms: Perfluorohexylbromide, Perfluorohexyl bromide, 1-Bromotridecafluorohexane, Tridecafluoro-1-bromohexane, 446882_ALDRICH, CID92755, EINECS 206-391-6, 1-Bromo-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane, Hexane, 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-, 335-56-8
• IUPAC Name: 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane
• Canonical SMILES: C(C(C(C(F)(F)Br)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F
• InChI Key: JTYRBFORUCBNHJ-UHFFFAOYSA-N
• Boiling Point: 100ºC
• Melting Point: -49ºC
• Flash Point: 13.3ºC
• Density: 1.871 g/mL at 25ºC(lit.)
• Appearance: COLORLESS LIQUID
• EC Number: 206-391-6
• Exact Mass: 397.89800
• Hazard Statements: H225-H302-H317-H334
• H-Bond Acceptor: 13
• H-Bond Donor: 0
• RIDADR: NONH for all modes of transport
• Safety Description: S23-S26-S36
• Symbol: GHS02
• WGK Germany: 3

Custom Q&A

What is the molecular formula of Perfluorohexyl bromide?

The molecular formula of Perfluorohexyl bromide is BrC6F13 or C6BrF13.

What is the molecular weight of Perfluorohexyl bromide?

The molecular weight of Perfluorohexyl bromide is 398.95 g/mol.

What is the IUPAC name of Perfluorohexyl bromide?

The IUPAC name of Perfluorohexyl bromide is 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane.

What is the InChI of Perfluorohexyl bromide?

The InChI of Perfluorohexyl bromide is InChI=1S/C6BrF13/c7-5(16,17)3(12,13)1(8,9)2(10,11)4(14,15)6(18,19)20.

What is the InChIKey of Perfluorohexyl bromide?

The InChIKey of Perfluorohexyl bromide is JTYRBFORUCBNHJ-UHFFFAOYSA-N.

What is the canonical SMILES of Perfluorohexyl bromide?

The canonical SMILES of Perfluorohexyl bromide is C(C(C(C(F)(F)Br)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F.

What is the CAS number of Perfluorohexyl bromide?

The CAS number of Perfluorohexyl bromide is 335-56-8.

What is the European Community (EC) number of Perfluorohexyl bromide?

The European Community (EC) number of Perfluorohexyl bromide is 206-391-6.

What is the DSSTox Substance ID of Perfluorohexyl bromide?

The DSSTox Substance ID of Perfluorohexyl bromide is DTXSID80187141.

Is Perfluorohexyl bromide a canonicalized compound?

Yes, Perfluorohexyl bromide is a canonicalized compound.