acetic acid;copper;dihydrate

C2H8CuO4 — CID 172826856

IUPACacetic acid;copper;dihydrate
SMILESCC(=O)O.O.O.[Cu]
InChIInChI=1S/C2H4O2.Cu.2H2O/c1-2(3)4;;;/h1H3,(H,3,4);;2*1H2
InChIKeyUZHAACHCWXGMIU-UHFFFAOYSA-N
MW159.63 g/mol
LogP-1.56
Rot. Bonds

About acetic acid;copper;dihydrate

acetic acid;copper;dihydrate (PubChem CID 172826856) has the molecular formula C2H8CuO4 and a molecular weight of 159.63 g/mol. Its IUPAC name is acetic acid;copper;dihydrate.

Molecular Properties

Compound Nameacetic acid;copper;dihydrate
PubChem CID172826856
Molecular FormulaC2H8CuO4
Molecular Weight159.63 g/mol
Exact Mass158.97
IUPAC Nameacetic acid;copper;dihydrate
SMILESCC(=O)O.O.O.[Cu]
InChIInChI=1S/C2H4O2.Cu.2H2O/c1-2(3)4;;;/h1H3,(H,3,4);;2*1H2
InChIKeyUZHAACHCWXGMIU-UHFFFAOYSA-N
XLogP-1.56
TPSA100.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.63
LogP ≤ 5-1.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 173007307
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Frequently Asked Questions

What is the IUPAC name of acetic acid;copper;dihydrate?
The IUPAC name of acetic acid;copper;dihydrate (CID 172826856) is acetic acid;copper;dihydrate.
What is the SMILES notation for acetic acid;copper;dihydrate?
The canonical SMILES for acetic acid;copper;dihydrate is CC(=O)O.O.O.[Cu].
What is the InChIKey of acetic acid;copper;dihydrate?
The InChIKey is UZHAACHCWXGMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.Cu.2H2O/c1-2(3)4;;;/h1H3,(H,3,4);;2*1H2.
What are the key properties of acetic acid;copper;dihydrate?
acetic acid;copper;dihydrate has a molecular weight of 159.63 g/mol, XLogP of -1.56, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;copper;dihydrate is sourced from PubChem (CID 172826856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).