CID 134840734

C8H7AgN2O2- — CID 134840734

IUPAC
SMILES[Ag+].[H]/[C-]=C1/CN=C2C=CC=CN21.[O][O-]
InChIInChI=1S/C8H7N2.Ag.O2/c1-7-6-9-8-4-2-3-5-10(7)8;;1-2/h1-5H,6H2;;/q-1;+1;-1
InChIKeySXYDEXHQHGNLTL-UHFFFAOYSA-N
MW271.02 g/mol
LogP-0.21
Rot. Bonds

About CID 134840734

CID 134840734 (PubChem CID 134840734) has the molecular formula C8H7AgN2O2- and a molecular weight of 271.02 g/mol.

Molecular Properties

Compound NameCID 134840734
PubChem CID134840734
Molecular FormulaC8H7AgN2O2-
Molecular Weight271.02 g/mol
Exact Mass269.96
IUPAC Name
SMILES[Ag+].[H]/[C-]=C1/CN=C2C=CC=CN21.[O][O-]
InChIInChI=1S/C8H7N2.Ag.O2/c1-7-6-9-8-4-2-3-5-10(7)8;;1-2/h1-5H,6H2;;/q-1;+1;-1
InChIKeySXYDEXHQHGNLTL-UHFFFAOYSA-N
XLogP-0.21
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.02
LogP ≤ 5-0.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 134840734?
The IUPAC name of CID 134840734 (CID 134840734) is not available.
What is the SMILES notation for CID 134840734?
The canonical SMILES for CID 134840734 is [Ag+].[H]/[C-]=C1/CN=C2C=CC=CN21.[O][O-].
What is the InChIKey of CID 134840734?
The InChIKey is SXYDEXHQHGNLTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N2.Ag.O2/c1-7-6-9-8-4-2-3-5-10(7)8;;1-2/h1-5H,6H2;;/q-1;+1;-1.
What are the key properties of CID 134840734?
CID 134840734 has a molecular weight of 271.02 g/mol, XLogP of -0.21, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134840734 is sourced from PubChem (CID 134840734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).