tritiophosphanylformaldehyde

CH3OP — CID 58788744

IUPACtritiophosphanylformaldehyde
SMILES[3H]PC=O
InChIInChI=1S/CH3OP/c2-1-3/h1H,3H2/i3T
InChIKeyWHPGTGCDKMKRNH-WJULDGBESA-N
MW64.02 g/mol
LogP0.05
Rot. Bonds1

About tritiophosphanylformaldehyde

tritiophosphanylformaldehyde (PubChem CID 58788744) has the molecular formula CH3OP and a molecular weight of 64.02 g/mol. Its IUPAC name is tritiophosphanylformaldehyde.

Molecular Properties

Compound Nametritiophosphanylformaldehyde
PubChem CID58788744
Molecular FormulaCH3OP
Molecular Weight64.02 g/mol
Exact Mass64.00
IUPAC Nametritiophosphanylformaldehyde
SMILES[3H]PC=O
InChIInChI=1S/CH3OP/c2-1-3/h1H,3H2/i3T
InChIKeyWHPGTGCDKMKRNH-WJULDGBESA-N
XLogP0.05
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms3
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50064.02
LogP ≤ 50.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tritiophosphanylformaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tritiophosphanylformaldehyde?
The IUPAC name of tritiophosphanylformaldehyde (CID 58788744) is tritiophosphanylformaldehyde.
What is the SMILES notation for tritiophosphanylformaldehyde?
The canonical SMILES for tritiophosphanylformaldehyde is [3H]PC=O.
What is the InChIKey of tritiophosphanylformaldehyde?
The InChIKey is WHPGTGCDKMKRNH-WJULDGBESA-N. The full InChI is InChI=1S/CH3OP/c2-1-3/h1H,3H2/i3T.
What are the key properties of tritiophosphanylformaldehyde?
tritiophosphanylformaldehyde has a molecular weight of 64.02 g/mol, XLogP of 0.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tritiophosphanylformaldehyde is sourced from PubChem (CID 58788744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).