[(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane

C28H25FGe — CID 23237171

IUPAC[(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane
SMILESF/C(=C/CCc1ccccc1)[Ge](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H25FGe/c29-28(23-13-16-24-14-5-1-6-15-24)30(25-17-7-2-8-18-25,26-19-9-3-10-20-26)27-21-11-4-12-22-27/h1-12,14-15,17-23H,13,16H2/b28-23-
InChIKeyTZRDZYLPLGQKIP-NFFVHWSESA-N
MW453.12 g/mol
LogP5.18
Rot. Bonds7

About [(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane

[(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane (PubChem CID 23237171) has the molecular formula C28H25FGe and a molecular weight of 453.12 g/mol. Its IUPAC name is [(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane.

Molecular Properties

Compound Name[(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane
PubChem CID23237171
Molecular FormulaC28H25FGe
Molecular Weight453.12 g/mol
Exact Mass454.12
IUPAC Name[(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane
SMILESF/C(=C/CCc1ccccc1)[Ge](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H25FGe/c29-28(23-13-16-24-14-5-1-6-15-24)30(25-17-7-2-8-18-25,26-19-9-3-10-20-26)27-21-11-4-12-22-27/h1-12,14-15,17-23H,13,16H2/b28-23-
InChIKeyTZRDZYLPLGQKIP-NFFVHWSESA-N
XLogP5.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500453.12
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of [(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane?
The IUPAC name of [(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane (CID 23237171) is [(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane.
What is the SMILES notation for [(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane?
The canonical SMILES for [(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane is F/C(=C/CCc1ccccc1)[Ge](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of [(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane?
The InChIKey is TZRDZYLPLGQKIP-NFFVHWSESA-N. The full InChI is InChI=1S/C28H25FGe/c29-28(23-13-16-24-14-5-1-6-15-24)30(25-17-7-2-8-18-25,26-19-9-3-10-20-26)27-21-11-4-12-22-27/h1-12,14-15,17-23H,13,16H2/b28-23-.
What are the key properties of [(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane?
[(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane has a molecular weight of 453.12 g/mol, XLogP of 5.18, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-1-fluoro-4-phenylbut-1-enyl]-triphenylgermane is sourced from PubChem (CID 23237171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).