10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene

C22H17As — CID 102314687

IUPAC10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene
SMILESC1=C\[As](c2ccccc2)/C=C\c2ccccc2-c2ccccc2/1
InChIInChI=1S/C22H17As/c1-2-10-20(11-3-1)23-16-14-18-8-4-6-12-21(18)22-13-7-5-9-19(22)15-17-23/h1-17H/b16-14-,17-15-
InChIKeyOEQNVFSAQHNOEA-RYOQUFEFSA-N
MW356.30 g/mol
LogP4.87
Rot. Bonds1

About 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene

10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene (PubChem CID 102314687) has the molecular formula C22H17As and a molecular weight of 356.30 g/mol. Its IUPAC name is 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene.

Molecular Properties

Compound Name10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene
PubChem CID102314687
Molecular FormulaC22H17As
Molecular Weight356.30 g/mol
Exact Mass356.05
IUPAC Name10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene
SMILESC1=C\[As](c2ccccc2)/C=C\c2ccccc2-c2ccccc2/1
InChIInChI=1S/C22H17As/c1-2-10-20(11-3-1)23-16-14-18-8-4-6-12-21(18)22-13-7-5-9-19(22)15-17-23/h1-17H/b16-14-,17-15-
InChIKeyOEQNVFSAQHNOEA-RYOQUFEFSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.30
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene?
The IUPAC name of 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene (CID 102314687) is 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene.
What is the SMILES notation for 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene?
The canonical SMILES for 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene is C1=C\[As](c2ccccc2)/C=C\c2ccccc2-c2ccccc2/1.
What is the InChIKey of 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene?
The InChIKey is OEQNVFSAQHNOEA-RYOQUFEFSA-N. The full InChI is InChI=1S/C22H17As/c1-2-10-20(11-3-1)23-16-14-18-8-4-6-12-21(18)22-13-7-5-9-19(22)15-17-23/h1-17H/b16-14-,17-15-.
What are the key properties of 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene?
10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene has a molecular weight of 356.30 g/mol, XLogP of 4.87, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-phenyl-10-arsatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,8,11,13,15-octaene is sourced from PubChem (CID 102314687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).