1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene

C15H10F4Se2 — CID 134932147

IUPAC1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene
SMILESF/C=C(/[Se]c1ccccc1)[Se]c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H10F4Se2/c16-10-14(20-12-4-2-1-3-5-12)21-13-8-6-11(7-9-13)15(17,18)19/h1-10H/b14-10-
InChIKeyWIEZWGFPYHVOTE-UVTDQMKNSA-N
MW424.16 g/mol
LogP2.83
Rot. Bonds4

About 1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene

1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene (PubChem CID 134932147) has the molecular formula C15H10F4Se2 and a molecular weight of 424.16 g/mol. Its IUPAC name is 1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene.

Molecular Properties

Compound Name1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene
PubChem CID134932147
Molecular FormulaC15H10F4Se2
Molecular Weight424.16 g/mol
Exact Mass425.90
IUPAC Name1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene
SMILESF/C=C(/[Se]c1ccccc1)[Se]c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H10F4Se2/c16-10-14(20-12-4-2-1-3-5-12)21-13-8-6-11(7-9-13)15(17,18)19/h1-10H/b14-10-
InChIKeyWIEZWGFPYHVOTE-UVTDQMKNSA-N
XLogP2.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.16
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene?
The IUPAC name of 1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene (CID 134932147) is 1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene.
What is the SMILES notation for 1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene?
The canonical SMILES for 1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene is F/C=C(/[Se]c1ccccc1)[Se]c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene?
The InChIKey is WIEZWGFPYHVOTE-UVTDQMKNSA-N. The full InChI is InChI=1S/C15H10F4Se2/c16-10-14(20-12-4-2-1-3-5-12)21-13-8-6-11(7-9-13)15(17,18)19/h1-10H/b14-10-.
What are the key properties of 1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene?
1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene has a molecular weight of 424.16 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-2-fluoro-1-phenylselanylethenyl]selanyl-4-(trifluoromethyl)benzene is sourced from PubChem (CID 134932147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).