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Molecule
ID:15948
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₀H₆I₂
Molecular Mass
379.96358
Exact Mass
379.85589619
Charge
0
InChI
InChI=1S/C10H6I2/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-6H
InChIKey
FFWAIAGCHIYVKA-UHFFFAOYSA-N
Canonic Smiles
Ic1cc2ccccc2cc1I
Isomeric Smiles
c1ccc2c(c1)cc(c(c2)I)I
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.8206115
LogD (pH = 7.4)
4.8206115
Log P
4.8206115
Molar Refractivity
69.2332
Polarizability
28.059654
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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General Information
Calculated Properties
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RDKit
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JChem
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Synonyms
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IUPAC Traditional name
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IUPAC name
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MDL Number
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CAS Number
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PubChem CID
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PubChem SID
Properties
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Product Information
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Safety Information
Related Proteins
Molecular Spectra
Molecule Details
References
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PubChem Literature
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From Data Sources
Bioactivity
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PubChem BioAssay
Data Source
Commercial Catalog
Matrix Scientific
016568
Academic Data
PubChem
10937756
Names and Identifiers
Synonyms
2,3-Diiodonaphthalene
IUPAC Traditional name
2,3-diiodonaphthalene
IUPAC name
2,3-diiodonaphthalene
Registration numbers
MDL Number
MFCD06656514
CAS Number
13214-70-5
PubChem CID
10937756
PubChem SID
160979255
Properties
Product Information
Purity
98%
Source
Safety Information
Storage Warning
IRRITANT
Source
TSCA Listed
false
Source
MSDS Link
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Source
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay