tetrakis(aziridine);dichlorocopper

C8H20Cl2CuN4 — CID 157452576

IUPACtetrakis(aziridine);dichlorocopper
SMILESC1CN1.C1CN1.C1CN1.C1CN1.Cl[Cu]Cl
InChIInChI=1S/4C2H5N.2ClH.Cu/c4*1-2-3-1;;;/h4*3H,1-2H2;2*1H;/q;;;;;;+2/p-2
InChIKeyBSYXMASRRMVSKL-UHFFFAOYSA-L
MW306.73 g/mol
LogP-0.27
Rot. Bonds

About tetrakis(aziridine);dichlorocopper

tetrakis(aziridine);dichlorocopper (PubChem CID 157452576) has the molecular formula C8H20Cl2CuN4 and a molecular weight of 306.73 g/mol. Its IUPAC name is tetrakis(aziridine);dichlorocopper.

Molecular Properties

Compound Nametetrakis(aziridine);dichlorocopper
PubChem CID157452576
Molecular FormulaC8H20Cl2CuN4
Molecular Weight306.73 g/mol
Exact Mass305.04
IUPAC Nametetrakis(aziridine);dichlorocopper
SMILESC1CN1.C1CN1.C1CN1.C1CN1.Cl[Cu]Cl
InChIInChI=1S/4C2H5N.2ClH.Cu/c4*1-2-3-1;;;/h4*3H,1-2H2;2*1H;/q;;;;;;+2/p-2
InChIKeyBSYXMASRRMVSKL-UHFFFAOYSA-L
XLogP-0.27
TPSA87.76 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.73
LogP ≤ 5-0.27
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

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copper 1,4,7,10-tetrazacyclododecane
CID 46241917
CID 67656711
CID 67656711
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CID 90266240
1,4,7,10,13,16-hexazacyclooctadecane;hexahydrate
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CID 87408128
CID 87408128
piperazine;tellane
CID 174387727
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Frequently Asked Questions

What is the IUPAC name of tetrakis(aziridine);dichlorocopper?
The IUPAC name of tetrakis(aziridine);dichlorocopper (CID 157452576) is tetrakis(aziridine);dichlorocopper.
What is the SMILES notation for tetrakis(aziridine);dichlorocopper?
The canonical SMILES for tetrakis(aziridine);dichlorocopper is C1CN1.C1CN1.C1CN1.C1CN1.Cl[Cu]Cl.
What is the InChIKey of tetrakis(aziridine);dichlorocopper?
The InChIKey is BSYXMASRRMVSKL-UHFFFAOYSA-L. The full InChI is InChI=1S/4C2H5N.2ClH.Cu/c4*1-2-3-1;;;/h4*3H,1-2H2;2*1H;/q;;;;;;+2/p-2.
What are the key properties of tetrakis(aziridine);dichlorocopper?
tetrakis(aziridine);dichlorocopper has a molecular weight of 306.73 g/mol, XLogP of -0.27, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(aziridine);dichlorocopper is sourced from PubChem (CID 157452576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).