1,8-Dibromoperfluorooctane

HCID 2736786
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Basic information

CAS
812-58-8
Standard SMILES
FC(F)(Br)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)Br
InChIKey
LYRJPHOHVRHNQH-UHFFFAOYSA-N
Molecular formula
C8Br2F16
Average molar mass
559.87 g/mol
Monoisotopic mass
557.81112572

Names & identifiers

Preferred name
1,8-Dibromoperfluorooctane
IUPAC
1,8-dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctane
English name
1,8-DIBROMOPERFLUOROOCTANE
Molecular formula
C8Br2F16
Molecular weight
559.87

Names & synonyms

1,8-Dibromoperfluorooctane812-58-8DTXSID80371604RefChem:221774DTXCID003226381,8-dibromohexadecafluorooctane1,8-dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctaneOctane,1,8-dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-MFCD00153111C8Br2F16Octane, 1,8-dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-octane
Show more names
1,8-Dibromoperfluorooctane96%1,8-Dibromoperfluorooctane 96%1,8-Dibromohexadecafluorooctane>1,8-Dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctane
Perfluoro-1,8-dibromooctaneSCHEMBL2166117AKOS015833869AS-72065SY050362DB-056505D3587A12856

Database identifiers

CAS
812-58-8
PubChem CID
2736786
DTXSID
DTXSID80371604
EC Number
670-420-2
Nikkaji
J753.974F

Properties

Computed structural properties

XLogP
7.3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
16
Rotatable bonds
7
Heavy atoms
26

Physicochemical properties

Melting point
40 °C · 40 °C
Boiling point
180 °C · 180 °C
Density
2 g/cm3 · 2 g/cm3
solubility
soluble in Methanol
form
powder to lump
color
White to Almost white

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

hs_code
29037800
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36/37/39

Chemistry & industry

Upstream & downstream products

Suppliers29 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
常州新氟化学有限公司13275212658 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]

Related reactions

1 records
New reaction record

Compound notes

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