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4H-Octafluoro-1-iodobutane

HCID 2775868
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
754-73-4
Standard SMILES
FC(F)C(F)(F)C(F)(F)C(F)(F)I
InChIKey
YOCZVAMFHOCNFS-UHFFFAOYSA-N
Molecular formula
C4HF8I
Average molar mass
327.94 g/mol
Monoisotopic mass
327.89952

Names & identifiers

Preferred name
4H-Octafluoro-1-iodobutane
IUPAC
1,1,2,2,3,3,4,4-octafluoro-1-iodobutane
English name
4H-Octafluoro-1-iodobutane
Molecular formula
C4HF8I
Molecular weight
327.94

Names & synonyms

4H-Octafluoro-1-iodobutaneRefChem:527379824-253-9754-73-41,1,2,2,3,3,4,4-octafluoro-1-iodobutane1-Iodo-4H-octafluorobutaneMFCD001558951,1,2,2,3,3,4,4-octafluoro-1-iodo-butaneC4HF8ISCHEMBL2471539SCHEMBL10704743DTXSID60379724
Show more names
Octafluoroiodobutane5H-OCTAFLUORO-1-IODOBUTANEButane, 1,1,2,2,3,3,4,4-octafluoro-1-iodo-
AKOS016015326DB-0559621-iodo-1,1,2,2,3,3,4,4-octafluorobutane4H-Octafluoro-1-iodobutane; 1,1,2,2,3,3,4,4-Octafluoro-1-iodobutane

Database identifiers

CAS
754-73-4
PubChem CID
2775868
DTXSID
DTXSID60379724
EC Number
824-253-9

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
3
Heavy atoms
13
Formal charge
0
Complexity
187

Physicochemical properties

Boiling point
85 °C · 85°C
Density
2.082 · 2.082±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
280 · P280-P261-P271
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
Hazard Note
Irritant
HS Code
2903780090 · 2903780090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

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
2903780090
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant
safety_code
26-36
Hazard statements
H315-H319-H335
Precautionary statements
P280-P261-P271

Chemistry & industry

Suppliers6 total

常州新氟化学有限公司0519-85528066; 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]
中科双航化学(大连)有限公司+86-411-66858498 13941194417 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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Compound notes

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