p-phenyl benzeneselenol

C12H9Se — CID 86061917

IUPAC—
SMILES[Se]c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H9Se/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
InChIKeySYJSXBAZKKEZMY-UHFFFAOYSA-N
MW232.16 g/mol
LogP2.15
Rot. Bonds1

About p-phenyl benzeneselenol

p-phenyl benzeneselenol (PubChem CID 86061917) has the molecular formula C12H9Se and a molecular weight of 232.16 g/mol.

Molecular Properties

Compound Namep-phenyl benzeneselenol
PubChem CID86061917
Molecular FormulaC12H9Se
Molecular Weight232.16 g/mol
Exact Mass232.99
IUPAC Name—
SMILES[Se]c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H9Se/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
InChIKeySYJSXBAZKKEZMY-UHFFFAOYSA-N
XLogP2.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.16
LogP ≤ 52.15
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

1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
benzene;tris(1,1'-biphenyl)
CID 162155747
1,4-bis[3-(3-phenylphenyl)phenyl]benzene
CID 123341500
1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene
CID 12623236
CID 139251089
CID 139251089
4,9,14,19,24-pentakis-phenylhexacyclo[20.3.1.12,6.17,11.112,16.117,21]triaconta-1(26),2(30),3,5,7(29),8,10,12(28),13,15,17,19,21(27),22,24-pentadecaene
CID 177480216
CID 139251088
CID 139251088
1,3,5-triphenylbenzene
CID 158331433
1,4-bis[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzene;ethane;1-phenyl-4-[4-[4-[4-[4-[4-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 162041275
1,1'-biphenyl;hydroiodide
CID 66586334
benzene;bis(1,1'-biphenyl);methane
CID 158742993
1,1'-biphenyl;indigane
CID 174363765

Frequently Asked Questions

What is the IUPAC name of p-phenyl benzeneselenol?
The IUPAC name of p-phenyl benzeneselenol (CID 86061917) is not available.
What is the SMILES notation for p-phenyl benzeneselenol?
The canonical SMILES for p-phenyl benzeneselenol is [Se]c1ccc(-c2ccccc2)cc1.
What is the InChIKey of p-phenyl benzeneselenol?
The InChIKey is SYJSXBAZKKEZMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Se/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H.
What are the key properties of p-phenyl benzeneselenol?
p-phenyl benzeneselenol has a molecular weight of 232.16 g/mol, XLogP of 2.15, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for p-phenyl benzeneselenol is sourced from PubChem (CID 86061917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).