bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride

C20H24Cl6N8Sn-2 — CID 159072250

IUPACbis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride
SMILESCl[Sn](Cl)(Cl)Cl.Nc1ccc(N)c2c(N)ccc(N)c12.Nc1ccc(N)c2c(N)ccc(N)c12.[Cl-].[Cl-]
InChIInChI=1S/2C10H12N4.6ClH.Sn/c2*11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10;;;;;;;/h2*1-4H,11-14H2;6*1H;/q;;;;;;;;+4/p-6
InChIKeyXLYSZUFKELUDJQ-UHFFFAOYSA-H
MW707.90 g/mol
LogP-1.28
Rot. Bonds

About bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride

bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride (PubChem CID 159072250) has the molecular formula C20H24Cl6N8Sn-2 and a molecular weight of 707.90 g/mol. Its IUPAC name is bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride.

Molecular Properties

Compound Namebis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride
PubChem CID159072250
Molecular FormulaC20H24Cl6N8Sn-2
Molecular Weight707.90 g/mol
Exact Mass705.93
IUPAC Namebis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride
SMILESCl[Sn](Cl)(Cl)Cl.Nc1ccc(N)c2c(N)ccc(N)c12.Nc1ccc(N)c2c(N)ccc(N)c12.[Cl-].[Cl-]
InChIInChI=1S/2C10H12N4.6ClH.Sn/c2*11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10;;;;;;;/h2*1-4H,11-14H2;6*1H;/q;;;;;;;;+4/p-6
InChIKeyXLYSZUFKELUDJQ-UHFFFAOYSA-H
XLogP-1.28
TPSA208.16 Ų
H-Bond Donors8
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500707.90
LogP ≤ 5-1.28
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride?
The IUPAC name of bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride (CID 159072250) is bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride.
What is the SMILES notation for bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride?
The canonical SMILES for bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride is Cl[Sn](Cl)(Cl)Cl.Nc1ccc(N)c2c(N)ccc(N)c12.Nc1ccc(N)c2c(N)ccc(N)c12.[Cl-].[Cl-].
What is the InChIKey of bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride?
The InChIKey is XLYSZUFKELUDJQ-UHFFFAOYSA-H. The full InChI is InChI=1S/2C10H12N4.6ClH.Sn/c2*11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10;;;;;;;/h2*1-4H,11-14H2;6*1H;/q;;;;;;;;+4/p-6.
What are the key properties of bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride?
bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride has a molecular weight of 707.90 g/mol, XLogP of -1.28, 0 rotatable bonds, 8 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(naphthalene-1,4,5,8-tetramine);tetrachlorostannane;dichloride is sourced from PubChem (CID 159072250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).