2-Chloro-1,1,1,4,4,4-hexafluorobutane

HCID 2736596CAS 400-43-1
Substructure searchFind similar structures

Basic information

Standard SMILES
FC(F)(F)CC(Cl)C(F)(F)F
InChIKey
PREWBNUKNNTMHC-UHFFFAOYSA-N
Molecular formula
C4H3ClF6
Average molar mass
200.51 g/mol
Monoisotopic mass
199.9827471

Names & identifiers

Preferred name
2-Chloro-1,1,1,4,4,4-hexafluorobutane
IUPAC
2-chloro-1,1,1,4,4,4-hexafluorobutane
English name
2-CHLORO-1,1,1,4,4,4-HEXAFLUOROBUTANE
Molecular formula
C4H3ClF6
Molecular weight
200.51

Names & synonyms

2-chloro-1,1,1,4,4,4-hexafluorobutane400-43-1DTXSID40371468RefChem:258162DTXCID50322502MFCD013207882-chloro-1,1,1,4,4,4-hexafluoro-butaneC4H3ClF6chlorohexafluorobutaneButane,2-chloro-1,1,1,4,4,4-hexafluoro-SCHEMBL2389415SBB092657
Show more names
Butane, 2-chloro-1,1,1,4,4,4-hexafluoro-2-Chloro-1,1,1,4,4,4-hexafluorobutane97%
AKOS0158488452-chloro-1,l,1,4,4,4-hexafluorobutane

Database identifiers

CAS
400-43-1
PubChem CID
2736596
DTXSID
DTXSID40371468

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
1
Heavy atoms
11

Physicochemical properties

Boiling point
48 · 48-49°C
refractive index
1.298 · 1.298
form
liquid
color
Clear
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety data

hs_code
2903779090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant
safety_code
23-24/25

Chemistry & industry

Suppliers5 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

7 records
New reaction record

Linked notes

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