1-methyl-5-phenyltetrazole;platinum

C8H7N4Pt- — CID 59661612

IUPAC1-methyl-5-phenyltetrazole;platinum
SMILESCn1nnnc1-c1[c-]cccc1.[Pt]
InChIInChI=1S/C8H7N4.Pt/c1-12-8(9-10-11-12)7-5-3-2-4-6-7;/h2-5H,1H3;/q-1;
InChIKeyAXHILZOUOFPEHX-UHFFFAOYSA-N
MW354.25 g/mol
LogP0.67
Rot. Bonds1

About 1-methyl-5-phenyltetrazole;platinum

1-methyl-5-phenyltetrazole;platinum (PubChem CID 59661612) has the molecular formula C8H7N4Pt- and a molecular weight of 354.25 g/mol. Its IUPAC name is 1-methyl-5-phenyltetrazole;platinum.

Molecular Properties

Compound Name1-methyl-5-phenyltetrazole;platinum
PubChem CID59661612
Molecular FormulaC8H7N4Pt-
Molecular Weight354.25 g/mol
Exact Mass354.03
IUPAC Name1-methyl-5-phenyltetrazole;platinum
SMILESCn1nnnc1-c1[c-]cccc1.[Pt]
InChIInChI=1S/C8H7N4.Pt/c1-12-8(9-10-11-12)7-5-3-2-4-6-7;/h2-5H,1H3;/q-1;
InChIKeyAXHILZOUOFPEHX-UHFFFAOYSA-N
XLogP0.67
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.25
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-phenyltetrazole;platinum?
The IUPAC name of 1-methyl-5-phenyltetrazole;platinum (CID 59661612) is 1-methyl-5-phenyltetrazole;platinum.
What is the SMILES notation for 1-methyl-5-phenyltetrazole;platinum?
The canonical SMILES for 1-methyl-5-phenyltetrazole;platinum is Cn1nnnc1-c1[c-]cccc1.[Pt].
What is the InChIKey of 1-methyl-5-phenyltetrazole;platinum?
The InChIKey is AXHILZOUOFPEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N4.Pt/c1-12-8(9-10-11-12)7-5-3-2-4-6-7;/h2-5H,1H3;/q-1;.
What are the key properties of 1-methyl-5-phenyltetrazole;platinum?
1-methyl-5-phenyltetrazole;platinum has a molecular weight of 354.25 g/mol, XLogP of 0.67, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-phenyltetrazole;platinum is sourced from PubChem (CID 59661612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).