dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium

C14H16O6P2+2 — CID 159366011

IUPACdihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium
SMILESO=[P+](O)O.O=[P+](OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C14H14O3P.HO3P/c15-18(16-11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14;1-4(2)3/h1-10H,11-12H2;(H-,1,2,3)/q+1;/p+1
InChIKeyVGGDHUGPQNQGKF-UHFFFAOYSA-O
MW342.22 g/mol
LogP3.71
Rot. Bonds6

About dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium

dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium (PubChem CID 159366011) has the molecular formula C14H16O6P2+2 and a molecular weight of 342.22 g/mol. Its IUPAC name is dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium.

Molecular Properties

Compound Namedihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium
PubChem CID159366011
Molecular FormulaC14H16O6P2+2
Molecular Weight342.22 g/mol
Exact Mass342.04
IUPAC Namedihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium
SMILESO=[P+](O)O.O=[P+](OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C14H14O3P.HO3P/c15-18(16-11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14;1-4(2)3/h1-10H,11-12H2;(H-,1,2,3)/q+1;/p+1
InChIKeyVGGDHUGPQNQGKF-UHFFFAOYSA-O
XLogP3.71
TPSA93.06 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.22
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

oxo-(2-phenylethoxy)-phenylmethoxyphosphanium
CID 70073621
methyl-oxo-phenylmethoxyphosphanium
CID 20566646
chloro-oxo-phenylmethoxyphosphanium
CID 23320599
oxo-bis(phenylmethoxymethoxy)phosphanium
CID 68931387
disodium bis(oxido-oxo-phenylmethoxyphosphanium)
CID 171808155
bis(benzylperoxy)-oxophosphanium
CID 22644121
bis(phenylmethoxy)phosphorylmethyl-oxo-phenylmethoxyphosphanium
CID 155609893
bis[[4-(difluoromethyl)phenyl]methoxy]-oxophosphanium
CID 175430868
oxo-pent-2-enyl-phenylmethoxyphosphanium
CID 74601015
benzyl 2-aminoacetate
CID 122130027
(4-bromophenyl)methoxy-ethoxy-oxophosphanium
CID 69294075
(2-oxo-2-phenylmethoxyethyl)azanium
CID 3684791

Frequently Asked Questions

What is the IUPAC name of dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium?
The IUPAC name of dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium (CID 159366011) is dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium.
What is the SMILES notation for dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium?
The canonical SMILES for dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium is O=[P+](O)O.O=[P+](OCc1ccccc1)OCc1ccccc1.
What is the InChIKey of dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium?
The InChIKey is VGGDHUGPQNQGKF-UHFFFAOYSA-O. The full InChI is InChI=1S/C14H14O3P.HO3P/c15-18(16-11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14;1-4(2)3/h1-10H,11-12H2;(H-,1,2,3)/q+1;/p+1.
What are the key properties of dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium?
dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium has a molecular weight of 342.22 g/mol, XLogP of 3.71, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium is sourced from PubChem (CID 159366011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).