copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate

C18H40Cl2CuN2O8 — CID 173220625

IUPACcopper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate
SMILESCC(C)(C)N(CCN(C(C)(C)C)C(C)(C)C)C(C)(C)C.[Cu+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/C18H40N2.2ClHO4.Cu/c1-15(2,3)19(16(4,5)6)13-14-20(17(7,8)9)18(10,11)12;2*2-1(3,4)5;/h13-14H2,1-12H3;2*(H,2,3,4,5);/q;;;+2/p-2
InChIKeyFDMFNFCWWSCPAP-UHFFFAOYSA-L
MW546.98 g/mol
LogP-4.73
Rot. Bonds3

About copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate

copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate (PubChem CID 173220625) has the molecular formula C18H40Cl2CuN2O8 and a molecular weight of 546.98 g/mol. Its IUPAC name is copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate.

Molecular Properties

Compound Namecopper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate
PubChem CID173220625
Molecular FormulaC18H40Cl2CuN2O8
Molecular Weight546.98 g/mol
Exact Mass545.15
IUPAC Namecopper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate
SMILESCC(C)(C)N(CCN(C(C)(C)C)C(C)(C)C)C(C)(C)C.[Cu+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/C18H40N2.2ClHO4.Cu/c1-15(2,3)19(16(4,5)6)13-14-20(17(7,8)9)18(10,11)12;2*2-1(3,4)5;/h13-14H2,1-12H3;2*(H,2,3,4,5);/q;;;+2/p-2
InChIKeyFDMFNFCWWSCPAP-UHFFFAOYSA-L
XLogP-4.73
TPSA190.96 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500546.98
LogP ≤ 5-4.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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Related Compounds

N,N-ditert-butylhexadecan-1-amine
CID 138920579
N-tert-butyl-2-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]propan-2-amine
CID 122631646
N,N-ditert-butyl-2-methylpropan-1-amine
CID 18314178
N,N'-ditert-butyl-N'-[2-(ditert-butylamino)ethyl]ethane-1,2-diamine
CID 87948910
N-[2-[but-2-enyl(dimethyl)silyl]ethyl]-N-tert-butyl-2-methylpropan-2-amine
CID 123509430
dimethylaminophosphanium perchlorate
CID 158506862
potassium;gold;2-methylpropan-2-olate
CID 174888257
2-[tert-butyl(propan-2-yl)amino]ethanol
CID 54545866
N-tert-butyl-N-ethyl-2-methylbutan-2-amine
CID 149170814
N-ethyl-N-(2-iodopropan-2-yl)-2-methylpropan-2-amine
CID 148639702
2-[bis(2-amino-3-methylbutan-2-yl)amino]ethanol
CID 87764605
N-tert-butyl-N-[3-[dimethyl(2-methylprop-2-enyl)silyl]propyl]-2-methylpropan-2-amine
CID 87397810

Frequently Asked Questions

What is the IUPAC name of copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate?
The IUPAC name of copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate (CID 173220625) is copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate.
What is the SMILES notation for copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate?
The canonical SMILES for copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate is CC(C)(C)N(CCN(C(C)(C)C)C(C)(C)C)C(C)(C)C.[Cu+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].
What is the InChIKey of copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate?
The InChIKey is FDMFNFCWWSCPAP-UHFFFAOYSA-L. The full InChI is InChI=1S/C18H40N2.2ClHO4.Cu/c1-15(2,3)19(16(4,5)6)13-14-20(17(7,8)9)18(10,11)12;2*2-1(3,4)5;/h13-14H2,1-12H3;2*(H,2,3,4,5);/q;;;+2/p-2.
What are the key properties of copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate?
copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate has a molecular weight of 546.98 g/mol, XLogP of -4.73, 3 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for copper;N,N,N',N'-tetratert-butylethane-1,2-diamine;diperchlorate is sourced from PubChem (CID 173220625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).