CID 50986602

C19H18P — CID 50986602

IUPAC—
SMILESC[P](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H18P/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19/h2-16H,1H3
InChIKeyWLEDPHKFODFOIV-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.61
Rot. Bonds3

About CID 50986602

CID 50986602 (PubChem CID 50986602) has the molecular formula C19H18P and a molecular weight of 277.33 g/mol.

Molecular Properties

Compound NameCID 50986602
PubChem CID50986602
Molecular FormulaC19H18P
Molecular Weight277.33 g/mol
Exact Mass277.11
IUPAC Name—
SMILESC[P](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H18P/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19/h2-16H,1H3
InChIKeyWLEDPHKFODFOIV-UHFFFAOYSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.61
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 CID 50986602?
The IUPAC name of CID 50986602 (CID 50986602) is not available.
What is the SMILES notation for CID 50986602?
The canonical SMILES for CID 50986602 is C[P](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 50986602?
The InChIKey is WLEDPHKFODFOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18P/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19/h2-16H,1H3.
What are the key properties of CID 50986602?
CID 50986602 has a molecular weight of 277.33 g/mol, XLogP of 3.61, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 50986602 is sourced from PubChem (CID 50986602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).