2-chloro-6-(1H-pyrrol-3-yl)benzenamine
TL;DR: 2-chloro-6-(1H-pyrrol-3-yl)benzenamine (CAS 75102-75-9) is a chemical compound with molecular formula C10H9ClN2 and molecular weight 192.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-6-(1H-pyrrol-3-yl)aniline
Also Known As: 4-Acpp, monodechloroaminopyrrolnitrin, 4-(2-Amino-3-chlorophenyl)pyrrole, 2-chloro-6-(1H-pyrrol-3-yl)aniline, 4- pyrrole
| Molecular Formula | C10H9ClN2 |
|---|---|
| Molecular Weight | 192.05 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.04543 |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 75102-75-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)N)C2=CNC=C2 |
| InChIKey | VLWKKIHFPGKVHZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-chloro-6-(1H-pyrrol-3-yl)benzenamine (CAS 75102-75-9), with molecular formula C10H9ClN2 and molecular weight 192.05 g/mol. IUPAC: 2-chloro-6-(1H-pyrrol-3-yl)aniline.
Chemical Property Profile of 2-chloro-6-(1H-pyrrol-3-yl)benzenamine
Property Insights of 2-chloro-6-(1H-pyrrol-3-yl)benzenamine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-6-(1H-pyrrol-3-yl)benzenamine. With a topological polar surface area (TPSA) of 41.8 Ų, 2-chloro-6-(1H-pyrrol-3-yl)benzenamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-6-(1H-pyrrol-3-yl)benzenamine has 2 hydrogen bond donor(s) and 1 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 2-chloro-6-(1H-pyrrol-3-yl)benzenamine?
The CAS number of 2-chloro-6-(1H-pyrrol-3-yl)benzenamine is 75102-75-9.
What is the molecular formula of 2-chloro-6-(1H-pyrrol-3-yl)benzenamine?
The molecular formula of 2-chloro-6-(1H-pyrrol-3-yl)benzenamine is C10H9ClN2.
What is the molecular weight of 2-chloro-6-(1H-pyrrol-3-yl)benzenamine?
The molecular weight of 2-chloro-6-(1H-pyrrol-3-yl)benzenamine is 192.05 g/mol.
Where can I buy 2-chloro-6-(1H-pyrrol-3-yl)benzenamine?
You can request a quote for 2-chloro-6-(1H-pyrrol-3-yl)benzenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-6-(1H-pyrrol-3-yl)benzenamine?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-6-(1H-pyrrol-3-yl)benzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.