CID 175980360

C25H20NaO — CID 175980360

IUPAC—
SMILESOc1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccc1.[Na]
InChIInChI=1S/C25H20O.Na/c26-24-19-11-10-18-23(24)25(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22;/h1-19,26H;
InChIKeyGSDOLXFLNGCNSY-UHFFFAOYSA-N
MW359.42 g/mol
LogP5.39
Rot. Bonds4

About CID 175980360

CID 175980360 (PubChem CID 175980360) has the molecular formula C25H20NaO and a molecular weight of 359.42 g/mol.

Molecular Properties

Compound NameCID 175980360
PubChem CID175980360
Molecular FormulaC25H20NaO
Molecular Weight359.42 g/mol
Exact Mass359.14
IUPAC Name—
SMILESOc1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccc1.[Na]
InChIInChI=1S/C25H20O.Na/c26-24-19-11-10-18-23(24)25(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22;/h1-19,26H;
InChIKeyGSDOLXFLNGCNSY-UHFFFAOYSA-N
XLogP5.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.42
LogP ≤ 55.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

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2-hydroxy-3-tritylbenzaldehyde
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Frequently Asked Questions

What is the IUPAC name of CID 175980360?
The IUPAC name of CID 175980360 (CID 175980360) is not available.
What is the SMILES notation for CID 175980360?
The canonical SMILES for CID 175980360 is Oc1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccc1.[Na].
What is the InChIKey of CID 175980360?
The InChIKey is GSDOLXFLNGCNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20O.Na/c26-24-19-11-10-18-23(24)25(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22;/h1-19,26H;.
What are the key properties of CID 175980360?
CID 175980360 has a molecular weight of 359.42 g/mol, XLogP of 5.39, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175980360 is sourced from PubChem (CID 175980360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).