sodium diethoxy-oxido-phenylimino-λ5-phosphane

C10H15NNaO3P — CID 134873244

IUPACsodium diethoxy-oxido-phenylimino-λ5-phosphane
SMILESCCOP([O-])(=Nc1ccccc1)OCC.[Na+]
InChIInChI=1S/C10H15NO3P.Na/c1-3-13-15(12,14-4-2)11-10-8-6-5-7-9-10;/h5-9H,3-4H2,1-2H3;/q-1;+1
InChIKeyCNYCGIMQVRLCKB-UHFFFAOYSA-N
MW251.20 g/mol
LogP-0.30
Rot. Bonds5

About sodium diethoxy-oxido-phenylimino-λ5-phosphane

sodium diethoxy-oxido-phenylimino-λ5-phosphane (PubChem CID 134873244) has the molecular formula C10H15NNaO3P and a molecular weight of 251.20 g/mol. Its IUPAC name is sodium diethoxy-oxido-phenylimino-λ5-phosphane.

Molecular Properties

Compound Namesodium diethoxy-oxido-phenylimino-λ5-phosphane
PubChem CID134873244
Molecular FormulaC10H15NNaO3P
Molecular Weight251.20 g/mol
Exact Mass251.07
IUPAC Namesodium diethoxy-oxido-phenylimino-λ5-phosphane
SMILESCCOP([O-])(=Nc1ccccc1)OCC.[Na+]
InChIInChI=1S/C10H15NO3P.Na/c1-3-13-15(12,14-4-2)11-10-8-6-5-7-9-10;/h5-9H,3-4H2,1-2H3;/q-1;+1
InChIKeyCNYCGIMQVRLCKB-UHFFFAOYSA-N
XLogP-0.30
TPSA53.88 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.20
LogP ≤ 5-0.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N,N-bis[diethoxy(phenylimino)-λ5-phosphanyl]methanamine
CID 23265155
1-[diethoxy(phenylimino)-lambda5-phosphanyl]-N,1-diphenylmethanimine
CID 13407637
diethoxy-(1-phenylethenoxy)-phenylimino-lambda5-phosphane
CID 13103962
diethyl 2-[1-[diethoxy(phenylimino)-lambda5-phosphanyl]oxyethylidene]propanedioate
CID 13110605
sodium 1-ethoxy-N-phenylmethanimidate
CID 23666386
N-[[diethoxy(phenylimino)-λ5-phosphanyl]-phenylmethyl]-1-phenylmethanimine
CID 23417708
(2-chlorocyclohexen-1-yl)oxy-diethoxy-phenylimino-λ5-phosphane
CID 23264979
sodium;ethoxy-[phenyl-(4-phenyldiazenylanilino)methyl]phosphinate;hydrate
CID 23696684
N-[(2,2-dichloro-1-phenylethenoxy)-ethoxy-phenylimino-λ5-phosphanyl]-N-ethylethanamine
CID 13103960
ethoxy-[(R)-phenyl-(phenylazaniumyl)methyl]phosphinate
CID 139059161
potassium benzylsulfanyl-ethoxy-oxido-sulfanylidene-λ5-phosphane
CID 70633644
sodium ethoxy(phenyl)phosphinite
CID 23703386

Frequently Asked Questions

What is the IUPAC name of sodium diethoxy-oxido-phenylimino-λ5-phosphane?
The IUPAC name of sodium diethoxy-oxido-phenylimino-λ5-phosphane (CID 134873244) is sodium diethoxy-oxido-phenylimino-λ5-phosphane.
What is the SMILES notation for sodium diethoxy-oxido-phenylimino-λ5-phosphane?
The canonical SMILES for sodium diethoxy-oxido-phenylimino-λ5-phosphane is CCOP([O-])(=Nc1ccccc1)OCC.[Na+].
What is the InChIKey of sodium diethoxy-oxido-phenylimino-λ5-phosphane?
The InChIKey is CNYCGIMQVRLCKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3P.Na/c1-3-13-15(12,14-4-2)11-10-8-6-5-7-9-10;/h5-9H,3-4H2,1-2H3;/q-1;+1.
What are the key properties of sodium diethoxy-oxido-phenylimino-λ5-phosphane?
sodium diethoxy-oxido-phenylimino-λ5-phosphane has a molecular weight of 251.20 g/mol, XLogP of -0.30, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium diethoxy-oxido-phenylimino-λ5-phosphane is sourced from PubChem (CID 134873244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).