![Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]- structure](/static/products/893/89303-10-6.png)
Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]-
TL;DR: Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]- (CAS 89303-10-6) is a chemical compound with molecular formula C13H10ClNO4S and molecular weight 311.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonylmethyl)-4-chloro-1-nitrobenzene
Also Known As: 5-chloro-2-nitrobenzyl phenyl sulfone, Phenyl(2-nitro-5-chlorobenzyl) sulfone, 2-(benzenesulfonylmethyl)-4-chloro-1-nitrobenzene, Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]-, J1.573.429I
| Molecular Formula | C13H10ClNO4S |
|---|---|
| Molecular Weight | 311.00 g/mol |
| LogP | 3.2221 |
| Topological Polar Surface Area | 77.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.0019 |
| Heavy Atoms | 20 |
| Complexity | 744.2214 |
Chemical Identifiers
| CAS Number | 89303-10-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC(=C2)Cl)[N+](=O)[O-] |
Product Overview
Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]- (CAS 89303-10-6), with molecular formula C13H10ClNO4S and molecular weight 311.00 g/mol. IUPAC: 2-(benzenesulfonylmethyl)-4-chloro-1-nitrobenzene.
Chemical Property Profile of Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]-
Property Insights of Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]-
The XLogP value of 3.2221 indicates that Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.28 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]-. Following Lipinski's Rule of Five, Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]- has 0 hydrogen bond donor(s) and 4 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, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]-?
The CAS number of Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]- is 89303-10-6.
What is the molecular formula of Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]-?
The molecular formula of Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]- is C13H10ClNO4S.
What is the molecular weight of Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]-?
The molecular weight of Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]- is 311.00 g/mol.
Where can I buy Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]-?
You can request a quote for Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 4-chloro-1-nitro-2-[(phenylsulfonyl)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.