triazanium;butylazanium;tetrabromide

C4H24Br4N4 — CID 139693201

IUPACtriazanium;butylazanium;tetrabromide
SMILESCCCC[NH3+].[Br-].[Br-].[Br-].[Br-].[NH4+].[NH4+].[NH4+]
InChIInChI=1S/C4H11N.4BrH.3H3N/c1-2-3-4-5;;;;;;;/h2-5H2,1H3;4*1H;3*1H3
InChIKeyLVTDVTARQQMJLZ-UHFFFAOYSA-N
MW447.88 g/mol
LogP-10.83
Rot. Bonds2

About triazanium;butylazanium;tetrabromide

triazanium;butylazanium;tetrabromide (PubChem CID 139693201) has the molecular formula C4H24Br4N4 and a molecular weight of 447.88 g/mol. Its IUPAC name is triazanium;butylazanium;tetrabromide.

Molecular Properties

Compound Nametriazanium;butylazanium;tetrabromide
PubChem CID139693201
Molecular FormulaC4H24Br4N4
Molecular Weight447.88 g/mol
Exact Mass443.87
IUPAC Nametriazanium;butylazanium;tetrabromide
SMILESCCCC[NH3+].[Br-].[Br-].[Br-].[Br-].[NH4+].[NH4+].[NH4+]
InChIInChI=1S/C4H11N.4BrH.3H3N/c1-2-3-4-5;;;;;;;/h2-5H2,1H3;4*1H;3*1H3
InChIKeyLVTDVTARQQMJLZ-UHFFFAOYSA-N
XLogP-10.83
TPSA137.14 Ų
H-Bond Donors4
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.88
LogP ≤ 5-10.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 100

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Related Compounds

butylazanium;hydride
CID 141334193
undecylazanium bromide
CID 87480687
tris(octadecylazanium);tribromide
CID 141071881
tetratriacontylazanium bromide
CID 141191350
dodecylazanium;bromide;hydrate
CID 139078665
copper;butylazanium;tetraazide
CID 88640537
dodecylazanium;hydrochloride
CID 22568612
butylazanium;sulfate
CID 86618199
butylazanium;oxalate
CID 19844195
tridecylazanium;chloride;hydrate
CID 139080710
butylazanium;oxolane;fluoride
CID 67136632
dodecylazanium tetrafluoroborate
CID 141181929

Frequently Asked Questions

What is the IUPAC name of triazanium;butylazanium;tetrabromide?
The IUPAC name of triazanium;butylazanium;tetrabromide (CID 139693201) is triazanium;butylazanium;tetrabromide.
What is the SMILES notation for triazanium;butylazanium;tetrabromide?
The canonical SMILES for triazanium;butylazanium;tetrabromide is CCCC[NH3+].[Br-].[Br-].[Br-].[Br-].[NH4+].[NH4+].[NH4+].
What is the InChIKey of triazanium;butylazanium;tetrabromide?
The InChIKey is LVTDVTARQQMJLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N.4BrH.3H3N/c1-2-3-4-5;;;;;;;/h2-5H2,1H3;4*1H;3*1H3.
What are the key properties of triazanium;butylazanium;tetrabromide?
triazanium;butylazanium;tetrabromide has a molecular weight of 447.88 g/mol, XLogP of -10.83, 2 rotatable bonds, 4 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triazanium;butylazanium;tetrabromide is sourced from PubChem (CID 139693201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).