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2-Fluoro-5-iodobenzotrifluoride

Catalog Number
ACM59382397
CAS Number
59382-39-7
Product Name
2-Fluoro-5-iodobenzotrifluoride
Structure
Category
Liquid Crystal (LC) Building Blocks
Synonyms
2-Fluoro-5-iodobenzotrifluoride;1-Fluoro-4-iodo-2-(trifluoromethyl)benzene
IUPAC Name
1-fluoro-4-iodo-2-(trifluoromethyl)benzene
Molecular Weight
290g/mol
Molecular Formula
C7H3F4I
Canonical SMILES
C1=CC(=C(C=C1I)C(F)(F)F)F
InChI
InChI=1S/C7H3F4I/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3H
InChI Key
DKLKYTATXLQGMX-UHFFFAOYSA-N
Complexity
156
Covalently-Bonded Unit Count
1
Exact Mass
289.92156g/mol
Formal Charge
0
Heavy Atom Count
12
Monoisotopic Mass
289.92156g/mol
Rotatable Bond Count
0
XLogP3
3.6
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