2-phenylselanylnaphthalene

C16H12Se — CID 10062344

IUPAC2-phenylselanylnaphthalene
SMILESc1ccc([Se]c2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H12Se/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h1-12H
InChIKeyOBHVXIYEZPDWLA-UHFFFAOYSA-N
MW283.23 g/mol
LogP2.49
Rot. Bonds2

About 2-phenylselanylnaphthalene

2-phenylselanylnaphthalene (PubChem CID 10062344) has the molecular formula C16H12Se and a molecular weight of 283.23 g/mol. Its IUPAC name is 2-phenylselanylnaphthalene.

Molecular Properties

Compound Name2-phenylselanylnaphthalene
PubChem CID10062344
Molecular FormulaC16H12Se
Molecular Weight283.23 g/mol
Exact Mass284.01
IUPAC Name2-phenylselanylnaphthalene
SMILESc1ccc([Se]c2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H12Se/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h1-12H
InChIKeyOBHVXIYEZPDWLA-UHFFFAOYSA-N
XLogP2.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.23
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-[(E)-2-[4-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]selanylphenyl]ethenyl]naphthalene
CID 59156066
phenylselanylbenzene;dihydrochloride
CID 173104242
anthracene;benzene;naphthalene
CID 142706236
1-phenylselanylnaphthalene
CID 11196823
2-[naphthalen-2-yl(phenylselanyl)phosphoryl]naphthalene
CID 155930984
naphthalene
CID 10240860
naphthalene
CID 21288458
benzene;2-methylnaphthalene
CID 159438891
anthracene;ethane;naphthalene
CID 159079166
anthracene;benzene;ethane;naphthalene;pyrene
CID 159655599
anthracene;naphthalene;phenanthrene
CID 158591187
2-chloro-1-naphthalen-2-yl-1-phenylhydrazine
CID 90345926

Frequently Asked Questions

What is the IUPAC name of 2-phenylselanylnaphthalene?
The IUPAC name of 2-phenylselanylnaphthalene (CID 10062344) is 2-phenylselanylnaphthalene.
What is the SMILES notation for 2-phenylselanylnaphthalene?
The canonical SMILES for 2-phenylselanylnaphthalene is c1ccc([Se]c2ccc3ccccc3c2)cc1.
What is the InChIKey of 2-phenylselanylnaphthalene?
The InChIKey is OBHVXIYEZPDWLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Se/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h1-12H.
What are the key properties of 2-phenylselanylnaphthalene?
2-phenylselanylnaphthalene has a molecular weight of 283.23 g/mol, XLogP of 2.49, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylselanylnaphthalene is sourced from PubChem (CID 10062344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).