2-Bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)pentane

HCID 2736247
NotesReactions
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Basic information

CAS
22528-67-2
Standard SMILES
FC(F)(F)C(F)(F)C(F)(F)C(Br)(C(F)(F)F)C(F)(F)F
InChIKey
LMULIUNHVQIBGA-UHFFFAOYSA-N
Molecular formula
C6BrF13
Average molar mass
398.95 g/mol
Monoisotopic mass
397.89757896

Names & identifiers

Preferred name
2-Bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)pentane
IUPAC
2-bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)pentane
English name
2-BROMO-1,1,1,3,3,4,4,5,5,5-DECAFLUORO-2-(TRIFLUOROMETHYL)PENTANE
Molecular formula
C6BrF13
Molecular weight
398.95

Names & synonyms

22528-67-22-bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)pentaneDTXSID90371231RefChem:256705DTXCID103222652-Bromoperfluoro(2-methylpentane)MFCD000775512-bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)-pentanePentane,2-bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)-perfluoro-2-bromo-2-methylpentaneperfluoro-t-hexyl bromide2-Bromodecafluoro-2-(trifluoromethyl)pentane
Show more names
Perfluoro-2-bromo-2-methylpentane97%Perfluoro-2-bromo-2-methylpentane 97%Pentane, 2-bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)-2-Bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)pentane97%2-Bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)pentane 97%
SCHEMBL103463532-Bromo-perfluoro(2-methylpentane)AKOS005258175NS00111904Heptafluoro-1,1-bis(trifluoromethyl)butyl bromide2-bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethy)pentane2-Bromo-2-(trifluoromethyl)perfluoropentane; 2-Bromo-decafluoro(2-methylpentane)

Database identifiers

CAS
22528-67-2
PubChem CID
2736247
DTXSID
DTXSID90371231

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
13
Rotatable bonds
2
Heavy atoms
20

Experimental & physicochemical properties

PFAS · 2 items

PFAS -> OECD Category

PFAS -> Other/unspecified

Physicochemical properties

Boiling point
99 · 99-101°C
EPA Substance Registry System
2 · 2-Bromo-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)pentane (22528-67-2)
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36/37/39
Hazard Note
Irritant

Safety & regulation

Safety data

hs_code
2914199090
risk_code
36/37/38
hazard_code
Xi
hazard_note
Irritant
safety_code
26-36/37/39

Chemistry & industry

Uses & manufacturing

Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category

Upstream & downstream products

Suppliers7 total

常州新氟化学有限公司13275212658 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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