HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.9
  1. Home
  2. /Compound

1,2,3,4-Tetrafluoro-5-iodo-6-(trifluoromethyl)benzene

HCID 228599
New noteNew reactionRequest quotesPrint preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
1478-08-6
Standard SMILES
Fc1c(F)c(F)c(C(F)(F)F)c(I)c1F
InChIKey
KRPNOQJVTIUPHA-UHFFFAOYSA-N
Molecular formula
C7F7I
Average molar mass
343.97 g/mol
Monoisotopic mass
343.89329

Names & identifiers

Preferred name
1,2,3,4-Tetrafluoro-5-iodo-6-(trifluoromethyl)benzene
IUPAC
1,2,3,4-tetrafluoro-5-iodo-6-(trifluoromethyl)benzene

Names & synonyms

1,2,3,4-tetrafluoro-5-iodo-6-(trifluoromethyl)benzene1478-08-6DTXSID90281427RefChem:214414DTXCID00232581NSC21633Benzene,1,2,3,4-tetrafluoro-5-iodo-6-(trifluoromethyl)-KRPNOQJVTIUPHA-UHFFFAOYSA-NNSC-21633DS-0099771,2,3,4-tetrafluoro-5-iodo-6-trifluoromethylbenzene

Database identifiers

CAS
1478-08-6
PubChem CID
228599
DTXSID
DTXSID90281427

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
0
Heavy atoms
15
Formal charge
0
Complexity
230

Suppliers

Loading…

Open inquiries

Loading…

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes