naphthalene-1,8-diselenol

C10H8Se2 — CID 5248106

IUPACnaphthalene-1,8-diselenol
SMILES[SeH]c1cccc2cccc([SeH])c12
InChIInChI=1S/C10H8Se2/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1-6,11-12H
InChIKeyWUVCLRKWFXSCOT-UHFFFAOYSA-N
MW286.09 g/mol
LogP-0.11
Rot. Bonds

About naphthalene-1,8-diselenol

naphthalene-1,8-diselenol (PubChem CID 5248106) has the molecular formula C10H8Se2 and a molecular weight of 286.09 g/mol. Its IUPAC name is naphthalene-1,8-diselenol.

Molecular Properties

Compound Namenaphthalene-1,8-diselenol
PubChem CID5248106
Molecular FormulaC10H8Se2
Molecular Weight286.09 g/mol
Exact Mass287.90
IUPAC Namenaphthalene-1,8-diselenol
SMILES[SeH]c1cccc2cccc([SeH])c12
InChIInChI=1S/C10H8Se2/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1-6,11-12H
InChIKeyWUVCLRKWFXSCOT-UHFFFAOYSA-N
XLogP-0.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.09
LogP ≤ 5-0.11
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

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pyrene;dihydrobromide
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pyrene;zirconium
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2-iodotricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene
CID 13067294
fluoranthene
CID 139203734
hexacyclo[11.7.1.14,20.02,11.03,8.017,21]docosa-1,3(8),4,6,9,11,13,15,17(21),18,20(22)-undecaene
CID 172997689
heptadecacyclo[28.20.2.22,5.26,9.231,34.110,14.135,39.03,26.04,23.07,22.08,19.027,51.032,47.033,44.048,52.018,56.043,53]hexaconta-1(51),2,4,6,8,10,12,14(56),15,17,19,21,23,25,27,29,31(55),32(47),33(44),34(54),35,37,39(53),40,42,45,48(52),49,57,59-triacontaene
CID 86057292
benzo[e]pyrene
CID 9128
1,2-dihydroacenaphthylene
CID 161018660
1,8-dimethylnaphthalene;ethane
CID 91447117
dilithium;(8-azanidylnaphthalen-1-yl)azanide
CID 177408168
acenaphthylene;benzene
CID 161131509

Frequently Asked Questions

What is the IUPAC name of naphthalene-1,8-diselenol?
The IUPAC name of naphthalene-1,8-diselenol (CID 5248106) is naphthalene-1,8-diselenol.
What is the SMILES notation for naphthalene-1,8-diselenol?
The canonical SMILES for naphthalene-1,8-diselenol is [SeH]c1cccc2cccc([SeH])c12.
What is the InChIKey of naphthalene-1,8-diselenol?
The InChIKey is WUVCLRKWFXSCOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Se2/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1-6,11-12H.
What are the key properties of naphthalene-1,8-diselenol?
naphthalene-1,8-diselenol has a molecular weight of 286.09 g/mol, XLogP of -0.11, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalene-1,8-diselenol is sourced from PubChem (CID 5248106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).