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Iodine I 131 iodomisonidazole structure
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Iodine I 131 iodomisonidazole

TL;DR: Iodine I 131 iodomisonidazole (CAS 164220-67-1) is a chemical compound with molecular formula C6H8IN3O3 and molecular weight 300.9627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-(131I)iodo-3-(2-nitroimidazol-1-yl)propan-2-ol

Also Known As: (131I)-Iodomisonidazole, Iodine I 131 iodomisonidazole, 1-iodo-3-(2-nitroimidazol-1-yl)propan-2-ol, 1-iodanyl-3-(2-nitroimidazol-1-yl)propan-2-ol, 1H-Imidazole-1-ethanol, alpha-(iodo-131I-methyl)-2-nitro-

CAS Number
164220-67-1
Molecular Formula
C6H8IN3O3
Molecular Weight
300.9627 g/mol
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Technical Specifications

Molecular FormulaC6H8IN3O3
Molecular Weight300.9627 g/mol
XLogP0.6
Topological Polar Surface Area (TPSA)83.9 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass300.9627 Da
Heavy Atoms13
Complexity186.0
SMILESC1=CN(C(=N1)[N+](=O)[O-])CC(C[131I])O
InChIKeyUORXEFUSRSSVJN-DMXXYFNZSA-N

Chemical Property Profile of Iodine I 131 iodomisonidazole

XLogP
0.6
TPSA (Topological Polar Surface Area)
83.9
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
13
Complexity
186.0
Exact Mass
300.9627
Monoisotopic Mass
300.9627
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Iodine I 131 iodomisonidazole

The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Iodine I 131 iodomisonidazole. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Iodine I 131 iodomisonidazole. Following Lipinski's Rule of Five, Iodine I 131 iodomisonidazole has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Iodine I 131 iodomisonidazole?

The CAS number of Iodine I 131 iodomisonidazole is 164220-67-1.

What is the molecular formula of Iodine I 131 iodomisonidazole?

The molecular formula of Iodine I 131 iodomisonidazole is C6H8IN3O3.

What is the molecular weight of Iodine I 131 iodomisonidazole?

The molecular weight of Iodine I 131 iodomisonidazole is 300.9627 g/mol.

Where can I buy Iodine I 131 iodomisonidazole?

You can request a quote for Iodine I 131 iodomisonidazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Iodine I 131 iodomisonidazole?

Yes, CoreyChem provides custom synthesis services for Iodine I 131 iodomisonidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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