1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene

C20H10I4 — CID 102479738

IUPAC1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene
SMILESIc1cc2ccccc2c(-c2c(I)c(I)cc3ccccc23)c1I
InChIInChI=1S/C20H10I4/c21-15-9-11-5-1-3-7-13(11)17(19(15)23)18-14-8-4-2-6-12(14)10-16(22)20(18)24/h1-10H
InChIKeyVCFDVGCQJFWHDJ-UHFFFAOYSA-N
MW757.92 g/mol
LogP8.08
Rot. Bonds1

About 1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene

1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene (PubChem CID 102479738) has the molecular formula C20H10I4 and a molecular weight of 757.92 g/mol. Its IUPAC name is 1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene.

Molecular Properties

Compound Name1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene
PubChem CID102479738
Molecular FormulaC20H10I4
Molecular Weight757.92 g/mol
Exact Mass757.70
IUPAC Name1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene
SMILESIc1cc2ccccc2c(-c2c(I)c(I)cc3ccccc23)c1I
InChIInChI=1S/C20H10I4/c21-15-9-11-5-1-3-7-13(11)17(19(15)23)18-14-8-4-2-6-12(14)10-16(22)20(18)24/h1-10H
InChIKeyVCFDVGCQJFWHDJ-UHFFFAOYSA-N
XLogP8.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500757.92
LogP ≤ 58.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-(2-hydroxy-3-iodonaphthalen-1-yl)-3-iodonaphthalen-2-ol
CID 171920783
1-(3-iodo-2-methoxynaphthalen-1-yl)-2-methoxy-3-methylnaphthalene
CID 58780214
3-bromo-2-iodo-1-(2-phenylphenyl)naphthalene
CID 71079311
1-iodo-10-phenylanthracene
CID 141156342
1-chloro-3-iodo-2-phenylnaphthalene
CID 141394667
2,4,6-tri(anthracen-9-yl)-1,3,5-triazine
CID 59336460
1,2,3-triiodotriphenylene
CID 174837521
13-iodopentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaene
CID 134198749
9-anthracen-9-ylanthracene;toluene
CID 86148014
3,4-diiodonaphthalen-1-amine
CID 74892032
acetonitrile;9-anthracen-9-ylanthracene
CID 71362371
3-(difluoromethoxy)-1-iodonaphthalene
CID 118814613

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene?
The IUPAC name of 1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene (CID 102479738) is 1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene.
What is the SMILES notation for 1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene?
The canonical SMILES for 1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene is Ic1cc2ccccc2c(-c2c(I)c(I)cc3ccccc23)c1I.
What is the InChIKey of 1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene?
The InChIKey is VCFDVGCQJFWHDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H10I4/c21-15-9-11-5-1-3-7-13(11)17(19(15)23)18-14-8-4-2-6-12(14)10-16(22)20(18)24/h1-10H.
What are the key properties of 1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene?
1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene has a molecular weight of 757.92 g/mol, XLogP of 8.08, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-diiodonaphthalen-1-yl)-2,3-diiodonaphthalene is sourced from PubChem (CID 102479738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).