9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane

C19H17P — CID 59017080

IUPAC9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane
SMILESC1=CC2c3ccccc3C(Pc3ccccc3)C2C=C1
InChIInChI=1S/C19H17P/c1-2-8-14(9-3-1)20-19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19/h1-13,15,17,19-20H
InChIKeyJRCWPAQOFFLRNI-UHFFFAOYSA-N
MW276.32 g/mol
LogP4.57
Rot. Bonds2

About 9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane

9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane (PubChem CID 59017080) has the molecular formula C19H17P and a molecular weight of 276.32 g/mol. Its IUPAC name is 9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane.

Molecular Properties

Compound Name9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane
PubChem CID59017080
Molecular FormulaC19H17P
Molecular Weight276.32 g/mol
Exact Mass276.11
IUPAC Name9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane
SMILESC1=CC2c3ccccc3C(Pc3ccccc3)C2C=C1
InChIInChI=1S/C19H17P/c1-2-8-14(9-3-1)20-19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19/h1-13,15,17,19-20H
InChIKeyJRCWPAQOFFLRNI-UHFFFAOYSA-N
XLogP4.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.32
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane?
The IUPAC name of 9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane (CID 59017080) is 9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane.
What is the SMILES notation for 9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane?
The canonical SMILES for 9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane is C1=CC2c3ccccc3C(Pc3ccccc3)C2C=C1.
What is the InChIKey of 9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane?
The InChIKey is JRCWPAQOFFLRNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17P/c1-2-8-14(9-3-1)20-19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19/h1-13,15,17,19-20H.
What are the key properties of 9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane?
9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane has a molecular weight of 276.32 g/mol, XLogP of 4.57, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9a-dihydro-4aH-fluoren-9-yl(phenyl)phosphane is sourced from PubChem (CID 59017080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).