copper;azane;dichloride;dihydrate

H7Cl2CuNO2 — CID 172840611

IUPACcopper;azane;dichloride;dihydrate
SMILESN.O.O.[Cl-].[Cl-].[Cu+2]
InChIInChI=1S/2ClH.Cu.H3N.2H2O/h2*1H;;1H3;2*1H2/q;;+2;;;/p-2
InChIKeyWSXWJVURNCMALE-UHFFFAOYSA-L
MW187.51 g/mol
LogP-7.48
Rot. Bonds

About copper;azane;dichloride;dihydrate

copper;azane;dichloride;dihydrate (PubChem CID 172840611) has the molecular formula H7Cl2CuNO2 and a molecular weight of 187.51 g/mol. Its IUPAC name is copper;azane;dichloride;dihydrate.

Molecular Properties

Compound Namecopper;azane;dichloride;dihydrate
PubChem CID172840611
Molecular FormulaH7Cl2CuNO2
Molecular Weight187.51 g/mol
Exact Mass185.91
IUPAC Namecopper;azane;dichloride;dihydrate
SMILESN.O.O.[Cl-].[Cl-].[Cu+2]
InChIInChI=1S/2ClH.Cu.H3N.2H2O/h2*1H;;1H3;2*1H2/q;;+2;;;/p-2
InChIKeyWSXWJVURNCMALE-UHFFFAOYSA-L
XLogP-7.48
TPSA98.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.51
LogP ≤ 5-7.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of copper;azane;dichloride;dihydrate?
The IUPAC name of copper;azane;dichloride;dihydrate (CID 172840611) is copper;azane;dichloride;dihydrate.
What is the SMILES notation for copper;azane;dichloride;dihydrate?
The canonical SMILES for copper;azane;dichloride;dihydrate is N.O.O.[Cl-].[Cl-].[Cu+2].
What is the InChIKey of copper;azane;dichloride;dihydrate?
The InChIKey is WSXWJVURNCMALE-UHFFFAOYSA-L. The full InChI is InChI=1S/2ClH.Cu.H3N.2H2O/h2*1H;;1H3;2*1H2/q;;+2;;;/p-2.
What are the key properties of copper;azane;dichloride;dihydrate?
copper;azane;dichloride;dihydrate has a molecular weight of 187.51 g/mol, XLogP of -7.48, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for copper;azane;dichloride;dihydrate is sourced from PubChem (CID 172840611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).