silver 1-ethynylnaphthalene

C12H7Ag — CID 15597420

IUPACsilver 1-ethynylnaphthalene
SMILES[Ag+].[C-]#Cc1cccc2ccccc12
InChIInChI=1S/C12H7.Ag/c1-2-10-7-5-8-11-6-3-4-9-12(10)11;/h3-9H;/q-1;+1
InChIKeyFHJMDLFEYKJYAO-UHFFFAOYSA-N
MW259.06 g/mol
LogP2.78
Rot. Bonds

About silver 1-ethynylnaphthalene

silver 1-ethynylnaphthalene (PubChem CID 15597420) has the molecular formula C12H7Ag and a molecular weight of 259.06 g/mol. Its IUPAC name is silver 1-ethynylnaphthalene.

Molecular Properties

Compound Namesilver 1-ethynylnaphthalene
PubChem CID15597420
Molecular FormulaC12H7Ag
Molecular Weight259.06 g/mol
Exact Mass257.96
IUPAC Namesilver 1-ethynylnaphthalene
SMILES[Ag+].[C-]#Cc1cccc2ccccc12
InChIInChI=1S/C12H7.Ag/c1-2-10-7-5-8-11-6-3-4-9-12(10)11;/h3-9H;/q-1;+1
InChIKeyFHJMDLFEYKJYAO-UHFFFAOYSA-N
XLogP2.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.06
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,8-bis(ethynyl)naphthalene
CID 58250679
naphthalene-1-carbonitrile;sulfane
CID 175607355
disilver;diphenylphosphaniumylmethyl(diphenyl)phosphanium;1-ethynylphenanthrene;9-ethynylphenanthrene
CID 162499694
disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene)
CID 162499534
2,3,6,7-tetrakis(2-naphthalen-1-ylethynyl)naphthalene
CID 177465758
1-[2-(2-naphthalen-1-ylethynylsulfanyl)ethynyl]naphthalene
CID 138857608
disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyl-5-phenylnaphthalene)
CID 162499763
3-naphthalen-1-ylprop-2-ynenitrile
CID 116791050
3-(2-naphthalen-1-ylethynyl)benzene-1,2-diol
CID 67420821
5,11,13,15-tetrakis(2-naphthalen-1-ylethynyl)tricyclo[8.2.2.24,7]hexadeca-1(12),4(16),5,7(15),10,13-hexaene
CID 122373167
potassium trifluoro(2-naphthalen-1-ylethynyl)boranuide
CID 135083871
copper;naphthalene-1-carbonitrile;diformate
CID 175354271

Frequently Asked Questions

What is the IUPAC name of silver 1-ethynylnaphthalene?
The IUPAC name of silver 1-ethynylnaphthalene (CID 15597420) is silver 1-ethynylnaphthalene.
What is the SMILES notation for silver 1-ethynylnaphthalene?
The canonical SMILES for silver 1-ethynylnaphthalene is [Ag+].[C-]#Cc1cccc2ccccc12.
What is the InChIKey of silver 1-ethynylnaphthalene?
The InChIKey is FHJMDLFEYKJYAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7.Ag/c1-2-10-7-5-8-11-6-3-4-9-12(10)11;/h3-9H;/q-1;+1.
What are the key properties of silver 1-ethynylnaphthalene?
silver 1-ethynylnaphthalene has a molecular weight of 259.06 g/mol, XLogP of 2.78, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for silver 1-ethynylnaphthalene is sourced from PubChem (CID 15597420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).