dihydroxy(oxo)phosphanium;methane;dihydrochloride

CH8Cl2O3P+ — CID 173320523

IUPACdihydroxy(oxo)phosphanium;methane;dihydrochloride
SMILESC.Cl.Cl.O=[P+](O)O
InChIInChI=1S/CH4.2ClH.HO3P/c;;;1-4(2)3/h1H4;2*1H;(H-,1,2,3)/p+1
InChIKeyWOGLHJNFVCMDNQ-UHFFFAOYSA-O
MW169.95 g/mol
LogP1.11
Rot. Bonds

About dihydroxy(oxo)phosphanium;methane;dihydrochloride

dihydroxy(oxo)phosphanium;methane;dihydrochloride (PubChem CID 173320523) has the molecular formula CH8Cl2O3P+ and a molecular weight of 169.95 g/mol. Its IUPAC name is dihydroxy(oxo)phosphanium;methane;dihydrochloride.

Molecular Properties

Compound Namedihydroxy(oxo)phosphanium;methane;dihydrochloride
PubChem CID173320523
Molecular FormulaCH8Cl2O3P+
Molecular Weight169.95 g/mol
Exact Mass168.96
IUPAC Namedihydroxy(oxo)phosphanium;methane;dihydrochloride
SMILESC.Cl.Cl.O=[P+](O)O
InChIInChI=1S/CH4.2ClH.HO3P/c;;;1-4(2)3/h1H4;2*1H;(H-,1,2,3)/p+1
InChIKeyWOGLHJNFVCMDNQ-UHFFFAOYSA-O
XLogP1.11
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.95
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

dihydroxy(oxo)phosphanium;dihydrochloride
CID 172680217
dihydroxy(oxo)phosphanium;methane;hydrofluoride
CID 174260259
bis(hydroxy-methyl-oxophosphanium);methane
CID 22015086
CID 172849342
CID 172849342
bis(dihydroxy(oxo)phosphanium);technetium-99
CID 6328361
dihydroxy(oxo)phosphanium;samarium
CID 161079463
cadmium(2+);dihydroxy(oxo)phosphanium
CID 22506351
CID 161252103
CID 161252103
bis(dihydroxy(oxo)phosphanium);phosphane
CID 172799064
CID 175732949
CID 175732949
dihydroxy(oxo)phosphanium;tungsten;hydrate
CID 20688098
tripotassium;dihydroxy(oxo)phosphanium;hydride
CID 173248438

Frequently Asked Questions

What is the IUPAC name of dihydroxy(oxo)phosphanium;methane;dihydrochloride?
The IUPAC name of dihydroxy(oxo)phosphanium;methane;dihydrochloride (CID 173320523) is dihydroxy(oxo)phosphanium;methane;dihydrochloride.
What is the SMILES notation for dihydroxy(oxo)phosphanium;methane;dihydrochloride?
The canonical SMILES for dihydroxy(oxo)phosphanium;methane;dihydrochloride is C.Cl.Cl.O=[P+](O)O.
What is the InChIKey of dihydroxy(oxo)phosphanium;methane;dihydrochloride?
The InChIKey is WOGLHJNFVCMDNQ-UHFFFAOYSA-O. The full InChI is InChI=1S/CH4.2ClH.HO3P/c;;;1-4(2)3/h1H4;2*1H;(H-,1,2,3)/p+1.
What are the key properties of dihydroxy(oxo)phosphanium;methane;dihydrochloride?
dihydroxy(oxo)phosphanium;methane;dihydrochloride has a molecular weight of 169.95 g/mol, XLogP of 1.11, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy(oxo)phosphanium;methane;dihydrochloride is sourced from PubChem (CID 173320523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).