CID 10974275

C19H18OP — CID 10974275

IUPAC
SMILESCOC[C]1[CH][CH][CH][C]1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H18OP/c1-20-15-16-9-8-14-19(16)21(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-14H,15H2,1H3
InChIKeyWTKMNQVMUWADOS-UHFFFAOYSA-N
MW293.33 g/mol
LogP3.50
Rot. Bonds5

About CID 10974275

CID 10974275 (PubChem CID 10974275) has the molecular formula C19H18OP and a molecular weight of 293.33 g/mol.

Molecular Properties

Compound NameCID 10974275
PubChem CID10974275
Molecular FormulaC19H18OP
Molecular Weight293.33 g/mol
Exact Mass293.11
IUPAC Name
SMILESCOC[C]1[CH][CH][CH][C]1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H18OP/c1-20-15-16-9-8-14-19(16)21(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-14H,15H2,1H3
InChIKeyWTKMNQVMUWADOS-UHFFFAOYSA-N
XLogP3.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 10974275?
The IUPAC name of CID 10974275 (CID 10974275) is not available.
What is the SMILES notation for CID 10974275?
The canonical SMILES for CID 10974275 is COC[C]1[CH][CH][CH][C]1P(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 10974275?
The InChIKey is WTKMNQVMUWADOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18OP/c1-20-15-16-9-8-14-19(16)21(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-14H,15H2,1H3.
What are the key properties of CID 10974275?
CID 10974275 has a molecular weight of 293.33 g/mol, XLogP of 3.50, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10974275 is sourced from PubChem (CID 10974275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).