dihydroxy(methylidene)phosphanium

CH4O2P+ — CID 59211327

IUPACdihydroxy(methylidene)phosphanium
SMILESC=[P+](O)O
InChIInChI=1S/CH4O2P/c1-4(2)3/h2-3H,1H2/q+1
InChIKeyNRAPDNULQQCDKN-UHFFFAOYSA-N
MW79.02 g/mol
LogP-0.29
Rot. Bonds

About dihydroxy(methylidene)phosphanium

dihydroxy(methylidene)phosphanium (PubChem CID 59211327) has the molecular formula CH4O2P+ and a molecular weight of 79.02 g/mol. Its IUPAC name is dihydroxy(methylidene)phosphanium.

Molecular Properties

Compound Namedihydroxy(methylidene)phosphanium
PubChem CID59211327
Molecular FormulaCH4O2P+
Molecular Weight79.02 g/mol
Exact Mass78.99
IUPAC Namedihydroxy(methylidene)phosphanium
SMILESC=[P+](O)O
InChIInChI=1S/CH4O2P/c1-4(2)3/h2-3H,1H2/q+1
InChIKeyNRAPDNULQQCDKN-UHFFFAOYSA-N
XLogP-0.29
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50079.02
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(Methylene)phosphinic acid
CID 19872324
formaldehyde;phosphenous acid
CID 54518051
bis(dihydroxy(oxo)phosphanium);ethene
CID 157056745
3-chlorobuta-1,3-dien-2-yl-hydroxy-oxophosphanium
CID 14978745
bis(dihydroxy(oxo)phosphanium);ethenol
CID 87088723
dihydroxy(oxo)phosphanium;ethenone
CID 174479647
dihydroxy(oxo)phosphanium;bis(prop-1-ene)
CID 87707073
methylidene-oxido-phosphorosooxycarbonylphosphanium
CID 175344049
CID 172849342
CID 172849342
bis(dihydroxy(oxo)phosphanium);technetium-99
CID 6328361
dihydroxy(oxo)phosphanium;samarium
CID 161079463
trisodium;phosphenous acid
CID 172758408

Frequently Asked Questions

What is the IUPAC name of dihydroxy(methylidene)phosphanium?
The IUPAC name of dihydroxy(methylidene)phosphanium (CID 59211327) is dihydroxy(methylidene)phosphanium.
What is the SMILES notation for dihydroxy(methylidene)phosphanium?
The canonical SMILES for dihydroxy(methylidene)phosphanium is C=[P+](O)O.
What is the InChIKey of dihydroxy(methylidene)phosphanium?
The InChIKey is NRAPDNULQQCDKN-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4O2P/c1-4(2)3/h2-3H,1H2/q+1.
What are the key properties of dihydroxy(methylidene)phosphanium?
dihydroxy(methylidene)phosphanium has a molecular weight of 79.02 g/mol, XLogP of -0.29, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy(methylidene)phosphanium is sourced from PubChem (CID 59211327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).