1,2,6,8-tetraiodonaphthalene

C10H4I4 — CID 153277420

IUPAC1,2,6,8-tetraiodonaphthalene
SMILESIc1cc(I)c2c(I)c(I)ccc2c1
InChIInChI=1S/C10H4I4/c11-6-3-5-1-2-7(12)10(14)9(5)8(13)4-6/h1-4H
InChIKeyMUCYVKQKQWWALY-UHFFFAOYSA-N
MW631.76 g/mol
LogP5.26
Rot. Bonds

About 1,2,6,8-tetraiodonaphthalene

1,2,6,8-tetraiodonaphthalene (PubChem CID 153277420) has the molecular formula C10H4I4 and a molecular weight of 631.76 g/mol. Its IUPAC name is 1,2,6,8-tetraiodonaphthalene.

Molecular Properties

Compound Name1,2,6,8-tetraiodonaphthalene
PubChem CID153277420
Molecular FormulaC10H4I4
Molecular Weight631.76 g/mol
Exact Mass631.65
IUPAC Name1,2,6,8-tetraiodonaphthalene
SMILESIc1cc(I)c2c(I)c(I)ccc2c1
InChIInChI=1S/C10H4I4/c11-6-3-5-1-2-7(12)10(14)9(5)8(13)4-6/h1-4H
InChIKeyMUCYVKQKQWWALY-UHFFFAOYSA-N
XLogP5.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500631.76
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2,6,8-tetraiodonaphthalene?
The IUPAC name of 1,2,6,8-tetraiodonaphthalene (CID 153277420) is 1,2,6,8-tetraiodonaphthalene.
What is the SMILES notation for 1,2,6,8-tetraiodonaphthalene?
The canonical SMILES for 1,2,6,8-tetraiodonaphthalene is Ic1cc(I)c2c(I)c(I)ccc2c1.
What is the InChIKey of 1,2,6,8-tetraiodonaphthalene?
The InChIKey is MUCYVKQKQWWALY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H4I4/c11-6-3-5-1-2-7(12)10(14)9(5)8(13)4-6/h1-4H.
What are the key properties of 1,2,6,8-tetraiodonaphthalene?
1,2,6,8-tetraiodonaphthalene has a molecular weight of 631.76 g/mol, XLogP of 5.26, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,6,8-tetraiodonaphthalene is sourced from PubChem (CID 153277420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).