oxo(polanylimino)methane

CHNOPo — CID 173033131

IUPACoxo(polanylimino)methane
SMILESO=C=N[PoH]
InChIInChI=1S/CNO.Po.H/c2-1-3;;/q-1;+1;
InChIKeyRDFMRVOZPGCFTD-UHFFFAOYSA-N
MW252.03 g/mol
LogP-0.86
Rot. Bonds

About oxo(polanylimino)methane

oxo(polanylimino)methane (PubChem CID 173033131) has the molecular formula CHNOPo and a molecular weight of 252.03 g/mol. Its IUPAC name is oxo(polanylimino)methane.

Molecular Properties

Compound Nameoxo(polanylimino)methane
PubChem CID173033131
Molecular FormulaCHNOPo
Molecular Weight252.03 g/mol
Exact Mass251.99
IUPAC Nameoxo(polanylimino)methane
SMILESO=C=N[PoH]
InChIInChI=1S/CNO.Po.H/c2-1-3;;/q-1;+1;
InChIKeyRDFMRVOZPGCFTD-UHFFFAOYSA-N
XLogP-0.86
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.03
LogP ≤ 5-0.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isocyanate', 'substructure': 'N/A'}

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Related Compounds

methylimino(oxo)methane;N-methylmethanamine
CID 172719912
potassium methanidylimino(oxo)methane
CID 151867234
CID 87698757
CID 87698757
bismuthane;isocyanatobismuthane
CID 173301787
3-isocyanatoprop-1-yne
CID 22352766
oxomethylidenecadmium;rhenium
CID 173440934
tetraisocyanatostannane
CID 141113751
1,1,2,2,3,3,4,4,5,5,6,6-dodecadeuterio-1,6-diisocyanatohexane
CID 171379013
benzene;1,2-diisocyanatobenzene
CID 159551146
methylcarbamic acid;methylimino(oxo)methane
CID 161055798
N-methylcarbamoyl chloride;methylimino(oxo)methane
CID 162155810
4-isocyanatoheptane
CID 22102269

Frequently Asked Questions

What is the IUPAC name of oxo(polanylimino)methane?
The IUPAC name of oxo(polanylimino)methane (CID 173033131) is oxo(polanylimino)methane.
What is the SMILES notation for oxo(polanylimino)methane?
The canonical SMILES for oxo(polanylimino)methane is O=C=N[PoH].
What is the InChIKey of oxo(polanylimino)methane?
The InChIKey is RDFMRVOZPGCFTD-UHFFFAOYSA-N. The full InChI is InChI=1S/CNO.Po.H/c2-1-3;;/q-1;+1;.
What are the key properties of oxo(polanylimino)methane?
oxo(polanylimino)methane has a molecular weight of 252.03 g/mol, XLogP of -0.86, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxo(polanylimino)methane is sourced from PubChem (CID 173033131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).