Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-
TL;DR: Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl- (CAS 67892-46-0) is a chemical compound with molecular formula C8H10ClNO3S and molecular weight 235.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-chloro-4-ethylbenzenesulfonic acid
Also Known As: 3-Amino-5-chloro-4-ethylbenzenesulfonic acid, Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-, 3-Amino-5-chloro-4-ethylbenzenesulphonic acid, 3-Amino-5-chloro-4-ethylbenzene-1-sulfonic acid, 3-amino-5-chloro-4-ethylbenzenesulphonicacid
| Molecular Formula | C8H10ClNO3S |
|---|---|
| Molecular Weight | 235.01 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.00699 |
| Heavy Atoms | 14 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 67892-46-0 |
|---|---|
| SMILES | CCC1=C(C=C(C=C1Cl)S(=O)(=O)O)N |
| InChIKey | ZXFQJBRYWYWLAM-UHFFFAOYSA-N |
Product Overview
Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl- (CAS 67892-46-0), with molecular formula C8H10ClNO3S and molecular weight 235.01 g/mol. IUPAC: 3-amino-5-chloro-4-ethylbenzenesulfonic acid.
Chemical Property Profile of Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-
Property Insights of Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-. Following Lipinski's Rule of Five, Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl- has 2 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 Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-?
The CAS number of Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl- is 67892-46-0.
What is the molecular formula of Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-?
The molecular formula of Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl- is C8H10ClNO3S.
What is the molecular weight of Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-?
The molecular weight of Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl- is 235.01 g/mol.
Where can I buy Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-?
You can request a quote for Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, 3-amino-5-chloro-4-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.