zinc;acetic acid;ethene

C6H10O2Zn — CID 157099074

IUPACzinc;acetic acid;ethene
SMILESCC(=O)O.[H][C-]=C.[H][C-]=C.[Zn+2]
InChIInChI=1S/C2H4O2.2C2H3.Zn/c1-2(3)4;2*1-2;/h1H3,(H,3,4);2*1H,2H2;/q;2*-1;+2
InChIKeySCDRXCVQDMEQAW-UHFFFAOYSA-N
MW179.53 g/mol
LogP1.30
Rot. Bonds

About zinc;acetic acid;ethene

zinc;acetic acid;ethene (PubChem CID 157099074) has the molecular formula C6H10O2Zn and a molecular weight of 179.53 g/mol. Its IUPAC name is zinc;acetic acid;ethene.

Molecular Properties

Compound Namezinc;acetic acid;ethene
PubChem CID157099074
Molecular FormulaC6H10O2Zn
Molecular Weight179.53 g/mol
Exact Mass178.00
IUPAC Namezinc;acetic acid;ethene
SMILESCC(=O)O.[H][C-]=C.[H][C-]=C.[Zn+2]
InChIInChI=1S/C2H4O2.2C2H3.Zn/c1-2(3)4;2*1-2;/h1H3,(H,3,4);2*1H,2H2;/q;2*-1;+2
InChIKeySCDRXCVQDMEQAW-UHFFFAOYSA-N
XLogP1.30
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.53
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

acetic acid;ethene;nickel
CID 154718775
acetic acid;ethene
CID 172797220
acetic acid
CID 158444727
acetic acid;2-methylprop-1-ene
CID 139328555
acetic acid;formaldehyde;hydrate
CID 19350045
acetic acid;methanol
CID 173388753
acetic acid;stibane
CID 173054099
acetic acid;ethane
CID 173226324
acetic acid;ethane
CID 173070051
acetic acid;cobalt
CID 54602348
acetic acid;cobalt
CID 59294242
acetic acid;tris(yttrium)
CID 59994727

Frequently Asked Questions

What is the IUPAC name of zinc;acetic acid;ethene?
The IUPAC name of zinc;acetic acid;ethene (CID 157099074) is zinc;acetic acid;ethene.
What is the SMILES notation for zinc;acetic acid;ethene?
The canonical SMILES for zinc;acetic acid;ethene is CC(=O)O.[H][C-]=C.[H][C-]=C.[Zn+2].
What is the InChIKey of zinc;acetic acid;ethene?
The InChIKey is SCDRXCVQDMEQAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.2C2H3.Zn/c1-2(3)4;2*1-2;/h1H3,(H,3,4);2*1H,2H2;/q;2*-1;+2.
What are the key properties of zinc;acetic acid;ethene?
zinc;acetic acid;ethene has a molecular weight of 179.53 g/mol, XLogP of 1.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;acetic acid;ethene is sourced from PubChem (CID 157099074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).