1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene

C18H19F2OP — CID 178181669

IUPAC1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene
SMILESO=P(c1ccc(F)cc1)(c1ccc(F)cc1)C1CCCCC1
InChIInChI=1S/C18H19F2OP/c19-14-6-10-17(11-7-14)22(21,16-4-2-1-3-5-16)18-12-8-15(20)9-13-18/h6-13,16H,1-5H2
InChIKeyFAVJDGXMPWAVFZ-UHFFFAOYSA-N
MW320.32 g/mol
LogP4.61
Rot. Bonds3

About 1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene

1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene (PubChem CID 178181669) has the molecular formula C18H19F2OP and a molecular weight of 320.32 g/mol. Its IUPAC name is 1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene.

Molecular Properties

Compound Name1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene
PubChem CID178181669
Molecular FormulaC18H19F2OP
Molecular Weight320.32 g/mol
Exact Mass320.11
IUPAC Name1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene
SMILESO=P(c1ccc(F)cc1)(c1ccc(F)cc1)C1CCCCC1
InChIInChI=1S/C18H19F2OP/c19-14-6-10-17(11-7-14)22(21,16-4-2-1-3-5-16)18-12-8-15(20)9-13-18/h6-13,16H,1-5H2
InChIKeyFAVJDGXMPWAVFZ-UHFFFAOYSA-N
XLogP4.61
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.32
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-[cyclohexyl-(4-fluorophenoxy)phosphoryl]oxy-4-fluorobenzene
CID 126689211
1-[cyclohexen-1-yl(cyclohexyl)phosphoryl]cycloheptene
CID 123358674
4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide
CID 2912791
N,N-dicyclohexyl-4-fluorobenzamide
CID 784952
2-cyclohexyl-1-(4-fluorophenyl)ethanone
CID 12505091
1-cycloheptyl-4-cyclopentyl-3-(4-fluorophenyl)piperazine-2,5-dione
CID 4186128
1-cycloheptyl-4-cyclooctyl-3-(4-fluorophenyl)piperazine-2,5-dione
CID 5064257
1-cyclohexyl-4-cyclopentyl-3-(4-fluorophenyl)piperazine-2,5-dione
CID 3553510
1-cycloheptyl-4-cyclohexyl-3-(4-fluorophenyl)piperazine-2,5-dione
CID 3287146
N-(cyclohexylmethyl)-2-(4-fluorophenyl)acetamide
CID 83278373
3,3-dichloro-1-cyclohexyl-2-(4-fluorophenyl)azetidine
CID 135050209
1-cyclopentyl-3-[(4-fluorophenyl)sulfonylmethyl]pyrazole
CID 64779328

Frequently Asked Questions

What is the IUPAC name of 1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene?
The IUPAC name of 1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene (CID 178181669) is 1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene.
What is the SMILES notation for 1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene?
The canonical SMILES for 1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene is O=P(c1ccc(F)cc1)(c1ccc(F)cc1)C1CCCCC1.
What is the InChIKey of 1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene?
The InChIKey is FAVJDGXMPWAVFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F2OP/c19-14-6-10-17(11-7-14)22(21,16-4-2-1-3-5-16)18-12-8-15(20)9-13-18/h6-13,16H,1-5H2.
What are the key properties of 1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene?
1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene has a molecular weight of 320.32 g/mol, XLogP of 4.61, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[cyclohexyl-(4-fluorophenyl)phosphoryl]-4-fluorobenzene is sourced from PubChem (CID 178181669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).