acetic acid;1-adamantylhydrazine;trichloroplatinum

C12H22Cl3N2O2Pt — CID 87438850

IUPACacetic acid;1-adamantylhydrazine;trichloroplatinum
SMILESCC(=O)O.Cl[Pt](Cl)Cl.NNC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C10H18N2.C2H4O2.3ClH.Pt/c11-12-10-4-7-1-8(5-10)3-9(2-7)6-10;1-2(3)4;;;;/h7-9,12H,1-6,11H2;1H3,(H,3,4);3*1H;/q;;;;;+3/p-3
InChIKeyQNXQVEFJIFTKOP-UHFFFAOYSA-K
MW527.76 g/mol
LogP3.58
Rot. Bonds1

About acetic acid;1-adamantylhydrazine;trichloroplatinum

acetic acid;1-adamantylhydrazine;trichloroplatinum (PubChem CID 87438850) has the molecular formula C12H22Cl3N2O2Pt and a molecular weight of 527.76 g/mol. Its IUPAC name is acetic acid;1-adamantylhydrazine;trichloroplatinum.

Molecular Properties

Compound Nameacetic acid;1-adamantylhydrazine;trichloroplatinum
PubChem CID87438850
Molecular FormulaC12H22Cl3N2O2Pt
Molecular Weight527.76 g/mol
Exact Mass526.04
IUPAC Nameacetic acid;1-adamantylhydrazine;trichloroplatinum
SMILESCC(=O)O.Cl[Pt](Cl)Cl.NNC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C10H18N2.C2H4O2.3ClH.Pt/c11-12-10-4-7-1-8(5-10)3-9(2-7)6-10;1-2(3)4;;;;/h7-9,12H,1-6,11H2;1H3,(H,3,4);3*1H;/q;;;;;+3/p-3
InChIKeyQNXQVEFJIFTKOP-UHFFFAOYSA-K
XLogP3.58
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500527.76
LogP ≤ 53.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of acetic acid;1-adamantylhydrazine;trichloroplatinum?
The IUPAC name of acetic acid;1-adamantylhydrazine;trichloroplatinum (CID 87438850) is acetic acid;1-adamantylhydrazine;trichloroplatinum.
What is the SMILES notation for acetic acid;1-adamantylhydrazine;trichloroplatinum?
The canonical SMILES for acetic acid;1-adamantylhydrazine;trichloroplatinum is CC(=O)O.Cl[Pt](Cl)Cl.NNC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of acetic acid;1-adamantylhydrazine;trichloroplatinum?
The InChIKey is QNXQVEFJIFTKOP-UHFFFAOYSA-K. The full InChI is InChI=1S/C10H18N2.C2H4O2.3ClH.Pt/c11-12-10-4-7-1-8(5-10)3-9(2-7)6-10;1-2(3)4;;;;/h7-9,12H,1-6,11H2;1H3,(H,3,4);3*1H;/q;;;;;+3/p-3.
What are the key properties of acetic acid;1-adamantylhydrazine;trichloroplatinum?
acetic acid;1-adamantylhydrazine;trichloroplatinum has a molecular weight of 527.76 g/mol, XLogP of 3.58, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;1-adamantylhydrazine;trichloroplatinum is sourced from PubChem (CID 87438850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).