ethane;3-ethylcyclohexen-1-ol;zinc

C10H19OZn- — CID 134851922

IUPACethane;3-ethylcyclohexen-1-ol;zinc
SMILESCCC1C=C(O)CCC1.[CH2-]C.[Zn]
InChIInChI=1S/C8H14O.C2H5.Zn/c1-2-7-4-3-5-8(9)6-7;1-2;/h6-7,9H,2-5H2,1H3;1H2,2H3;/q;-1;
InChIKeyQAQAAMHCZPCNRD-UHFFFAOYSA-N
MW220.65 g/mol
LogP3.48
Rot. Bonds1

About ethane;3-ethylcyclohexen-1-ol;zinc

ethane;3-ethylcyclohexen-1-ol;zinc (PubChem CID 134851922) has the molecular formula C10H19OZn- and a molecular weight of 220.65 g/mol. Its IUPAC name is ethane;3-ethylcyclohexen-1-ol;zinc.

Molecular Properties

Compound Nameethane;3-ethylcyclohexen-1-ol;zinc
PubChem CID134851922
Molecular FormulaC10H19OZn-
Molecular Weight220.65 g/mol
Exact Mass219.07
IUPAC Nameethane;3-ethylcyclohexen-1-ol;zinc
SMILESCCC1C=C(O)CCC1.[CH2-]C.[Zn]
InChIInChI=1S/C8H14O.C2H5.Zn/c1-2-7-4-3-5-8(9)6-7;1-2;/h6-7,9H,2-5H2,1H3;1H2,2H3;/q;-1;
InChIKeyQAQAAMHCZPCNRD-UHFFFAOYSA-N
XLogP3.48
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.65
LogP ≤ 53.48
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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Frequently Asked Questions

What is the IUPAC name of ethane;3-ethylcyclohexen-1-ol;zinc?
The IUPAC name of ethane;3-ethylcyclohexen-1-ol;zinc (CID 134851922) is ethane;3-ethylcyclohexen-1-ol;zinc.
What is the SMILES notation for ethane;3-ethylcyclohexen-1-ol;zinc?
The canonical SMILES for ethane;3-ethylcyclohexen-1-ol;zinc is CCC1C=C(O)CCC1.[CH2-]C.[Zn].
What is the InChIKey of ethane;3-ethylcyclohexen-1-ol;zinc?
The InChIKey is QAQAAMHCZPCNRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O.C2H5.Zn/c1-2-7-4-3-5-8(9)6-7;1-2;/h6-7,9H,2-5H2,1H3;1H2,2H3;/q;-1;.
What are the key properties of ethane;3-ethylcyclohexen-1-ol;zinc?
ethane;3-ethylcyclohexen-1-ol;zinc has a molecular weight of 220.65 g/mol, XLogP of 3.48, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethylcyclohexen-1-ol;zinc is sourced from PubChem (CID 134851922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).