2-phenylazete

C9H7N — CID 91343719

IUPAC2-phenylazete
SMILESC1=CC(c2ccccc2)=N1
InChIInChI=1S/C9H7N/c1-2-4-8(5-3-1)9-6-7-10-9/h1-7H
InChIKeyWYODVAZJZHZODW-UHFFFAOYSA-N
MW129.16 g/mol
LogP2.00
Rot. Bonds1

About 2-phenylazete

2-phenylazete (PubChem CID 91343719) has the molecular formula C9H7N and a molecular weight of 129.16 g/mol. Its IUPAC name is 2-phenylazete.

Molecular Properties

Compound Name2-phenylazete
PubChem CID91343719
Molecular FormulaC9H7N
Molecular Weight129.16 g/mol
Exact Mass129.06
IUPAC Name2-phenylazete
SMILESC1=CC(c2ccccc2)=N1
InChIInChI=1S/C9H7N/c1-2-4-8(5-3-1)9-6-7-10-9/h1-7H
InChIKeyWYODVAZJZHZODW-UHFFFAOYSA-N
XLogP2.00
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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bis(1,1'-biphenyl);sulfane
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CID 162140615
benzene;bis(1,1'-biphenyl);methane
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1,1'-biphenyl;hydroiodide
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1,1'-biphenyl;indigane
CID 174363765
CID 53446764
CID 53446764
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
5-phenyl-1,2,6-oxathiazine
CID 141013247

Frequently Asked Questions

What is the IUPAC name of 2-phenylazete?
The IUPAC name of 2-phenylazete (CID 91343719) is 2-phenylazete.
What is the SMILES notation for 2-phenylazete?
The canonical SMILES for 2-phenylazete is C1=CC(c2ccccc2)=N1.
What is the InChIKey of 2-phenylazete?
The InChIKey is WYODVAZJZHZODW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N/c1-2-4-8(5-3-1)9-6-7-10-9/h1-7H.
What are the key properties of 2-phenylazete?
2-phenylazete has a molecular weight of 129.16 g/mol, XLogP of 2.00, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylazete is sourced from PubChem (CID 91343719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).