phosphane;triethyl(phenyl)azanium;bromide;hydrobromide

C12H24Br2NP — CID 174774138

IUPACphosphane;triethyl(phenyl)azanium;bromide;hydrobromide
SMILESBr.CC[N+](CC)(CC)c1ccccc1.P.[Br-]
InChIInChI=1S/C12H20N.2BrH.H3P/c1-4-13(5-2,6-3)12-10-8-7-9-11-12;;;/h7-11H,4-6H2,1-3H3;2*1H;1H3/q+1;;;/p-1
InChIKeyHFRIPIJYZPOUFZ-UHFFFAOYSA-M
MW373.11 g/mol
LogP0.69
Rot. Bonds4

About phosphane;triethyl(phenyl)azanium;bromide;hydrobromide

phosphane;triethyl(phenyl)azanium;bromide;hydrobromide (PubChem CID 174774138) has the molecular formula C12H24Br2NP and a molecular weight of 373.11 g/mol. Its IUPAC name is phosphane;triethyl(phenyl)azanium;bromide;hydrobromide.

Molecular Properties

Compound Namephosphane;triethyl(phenyl)azanium;bromide;hydrobromide
PubChem CID174774138
Molecular FormulaC12H24Br2NP
Molecular Weight373.11 g/mol
Exact Mass371.00
IUPAC Namephosphane;triethyl(phenyl)azanium;bromide;hydrobromide
SMILESBr.CC[N+](CC)(CC)c1ccccc1.P.[Br-]
InChIInChI=1S/C12H20N.2BrH.H3P/c1-4-13(5-2,6-3)12-10-8-7-9-11-12;;;/h7-11H,4-6H2,1-3H3;2*1H;1H3/q+1;;;/p-1
InChIKeyHFRIPIJYZPOUFZ-UHFFFAOYSA-M
XLogP0.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.11
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

triethyl(phenyl)azanium hydroxide
CID 2735149
triethyl(phenyl)azanium;hydroxide;hydrofluoride
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azane;triethyl(phenyl)azanium;hydrate
CID 174742361
oxido(oxo)borane;triethyl(phenyl)azanium
CID 14746837
propanoate;triethyl(phenyl)azanium
CID 146567529
dimethyl-di(propan-2-yl)azanium;triethyl(phenyl)azanium
CID 159297233
diethyl-hexadecyl-phenylazanium bromide
CID 163210930
diethyl-heptadecyl-phenylazanium
CID 163210934
diethyl-icosyl-phenylazanium bromide
CID 163210919
dodecyl-diethyl-phenylazanium chloride
CID 70521087
diethyl-octyl-phenylazanium iodide
CID 175060834
2-hydroxypropane-1,2,3-tricarboxylic acid;triethyl(phenyl)azanium
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Frequently Asked Questions

What is the IUPAC name of phosphane;triethyl(phenyl)azanium;bromide;hydrobromide?
The IUPAC name of phosphane;triethyl(phenyl)azanium;bromide;hydrobromide (CID 174774138) is phosphane;triethyl(phenyl)azanium;bromide;hydrobromide.
What is the SMILES notation for phosphane;triethyl(phenyl)azanium;bromide;hydrobromide?
The canonical SMILES for phosphane;triethyl(phenyl)azanium;bromide;hydrobromide is Br.CC[N+](CC)(CC)c1ccccc1.P.[Br-].
What is the InChIKey of phosphane;triethyl(phenyl)azanium;bromide;hydrobromide?
The InChIKey is HFRIPIJYZPOUFZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C12H20N.2BrH.H3P/c1-4-13(5-2,6-3)12-10-8-7-9-11-12;;;/h7-11H,4-6H2,1-3H3;2*1H;1H3/q+1;;;/p-1.
What are the key properties of phosphane;triethyl(phenyl)azanium;bromide;hydrobromide?
phosphane;triethyl(phenyl)azanium;bromide;hydrobromide has a molecular weight of 373.11 g/mol, XLogP of 0.69, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phosphane;triethyl(phenyl)azanium;bromide;hydrobromide is sourced from PubChem (CID 174774138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).