Benzene, 1,3-dichloro-2-iodo-5-nitro-
TL;DR: Benzene, 1,3-dichloro-2-iodo-5-nitro- (CAS 62778-19-2) is a chemical compound with molecular formula C6H2Cl2INO2 and molecular weight 316.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dichloro-2-iodo-5-nitrobenzene
Also Known As: 1,3-Dichloro-2-iodo-5-nitrobenzene, 3,5-Dichloro-4-iodonitrobenzene, LiBOB, Benzene, 1,3-dichloro-2-iodo-5-nitro-, 4-iodo-3,5-dichloro-nitrobenzene
| Molecular Formula | C6H2Cl2INO2 |
|---|---|
| Molecular Weight | 316.85 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 316.85074 |
| Heavy Atoms | 12 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 62778-19-2 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Cl)I)Cl)[N+](=O)[O-] |
| InChIKey | FCDBEIIBODDDEJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1,3-dichloro-2-iodo-5-nitro- (CAS 62778-19-2), with molecular formula C6H2Cl2INO2 and molecular weight 316.85 g/mol. IUPAC: 1,3-dichloro-2-iodo-5-nitrobenzene.
Chemical Property Profile of Benzene, 1,3-dichloro-2-iodo-5-nitro-
Property Insights of Benzene, 1,3-dichloro-2-iodo-5-nitro-
The XLogP value of 3.7 indicates that Benzene, 1,3-dichloro-2-iodo-5-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, Benzene, 1,3-dichloro-2-iodo-5-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1,3-dichloro-2-iodo-5-nitro- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, 1,3-dichloro-2-iodo-5-nitro-?
The CAS number of Benzene, 1,3-dichloro-2-iodo-5-nitro- is 62778-19-2.
What is the molecular formula of Benzene, 1,3-dichloro-2-iodo-5-nitro-?
The molecular formula of Benzene, 1,3-dichloro-2-iodo-5-nitro- is C6H2Cl2INO2.
What is the molecular weight of Benzene, 1,3-dichloro-2-iodo-5-nitro-?
The molecular weight of Benzene, 1,3-dichloro-2-iodo-5-nitro- is 316.85 g/mol.
Where can I buy Benzene, 1,3-dichloro-2-iodo-5-nitro-?
You can request a quote for Benzene, 1,3-dichloro-2-iodo-5-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1,3-dichloro-2-iodo-5-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1,3-dichloro-2-iodo-5-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.