1-ethynylcyclohexan-1-ol;platinum(2+)

C8H12OPt+2 — CID 23175181

IUPAC1-ethynylcyclohexan-1-ol;platinum(2+)
SMILESC#CC1(O)CCCCC1.[Pt+2]
InChIInChI=1S/C8H12O.Pt/c1-2-8(9)6-4-3-5-7-8;/h1,9H,3-7H2;/q;+2
InChIKeyLHXBBYVBYUAZDM-UHFFFAOYSA-N
MW319.26 g/mol
LogP1.31
Rot. Bonds

About 1-ethynylcyclohexan-1-ol;platinum(2+)

1-ethynylcyclohexan-1-ol;platinum(2+) (PubChem CID 23175181) has the molecular formula C8H12OPt+2 and a molecular weight of 319.26 g/mol. Its IUPAC name is 1-ethynylcyclohexan-1-ol;platinum(2+).

Molecular Properties

Compound Name1-ethynylcyclohexan-1-ol;platinum(2+)
PubChem CID23175181
Molecular FormulaC8H12OPt+2
Molecular Weight319.26 g/mol
Exact Mass319.05
IUPAC Name1-ethynylcyclohexan-1-ol;platinum(2+)
SMILESC#CC1(O)CCCCC1.[Pt+2]
InChIInChI=1S/C8H12O.Pt/c1-2-8(9)6-4-3-5-7-8;/h1,9H,3-7H2;/q;+2
InChIKeyLHXBBYVBYUAZDM-UHFFFAOYSA-N
XLogP1.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.26
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-ethynylcyclohexan-1-ol;platinum(2+)?
The IUPAC name of 1-ethynylcyclohexan-1-ol;platinum(2+) (CID 23175181) is 1-ethynylcyclohexan-1-ol;platinum(2+).
What is the SMILES notation for 1-ethynylcyclohexan-1-ol;platinum(2+)?
The canonical SMILES for 1-ethynylcyclohexan-1-ol;platinum(2+) is C#CC1(O)CCCCC1.[Pt+2].
What is the InChIKey of 1-ethynylcyclohexan-1-ol;platinum(2+)?
The InChIKey is LHXBBYVBYUAZDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O.Pt/c1-2-8(9)6-4-3-5-7-8;/h1,9H,3-7H2;/q;+2.
What are the key properties of 1-ethynylcyclohexan-1-ol;platinum(2+)?
1-ethynylcyclohexan-1-ol;platinum(2+) has a molecular weight of 319.26 g/mol, XLogP of 1.31, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethynylcyclohexan-1-ol;platinum(2+) is sourced from PubChem (CID 23175181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).