2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol
TL;DR: 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol (CAS 647841-63-2) is a chemical compound with molecular formula C12H12ClNO and molecular weight 221.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-(2,5-dimethylpyrrol-1-yl)phenol
Also Known As: 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol, 2-Chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)phenol, chlorodimethylpyrrolylbenzenol, 2-chloro-4-(2,5-dimethylpyrrol-1-yl)phenol, 7380AE
| Molecular Formula | C12H12ClNO |
|---|---|
| Molecular Weight | 221.06 g/mol |
| LogP | 3.45314 |
| Topological Polar Surface Area | 25.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.06075 |
| Heavy Atoms | 15 |
| Complexity | 482.8184 |
Chemical Identifiers
| CAS Number | 647841-63-2 |
|---|---|
| SMILES | CC1=CC=C(N1C2=CC(=C(C=C2)O)Cl)C |
Product Overview
2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol (CAS 647841-63-2), with molecular formula C12H12ClNO and molecular weight 221.06 g/mol. IUPAC: 2-chloro-4-(2,5-dimethylpyrrol-1-yl)phenol.
Chemical Property Profile of 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol
Property Insights of 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol
The XLogP value of 3.45314 indicates that 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.16 Ų, 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol has 1 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-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol?
The CAS number of 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol is 647841-63-2.
What is the molecular formula of 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol?
The molecular formula of 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol is C12H12ClNO.
What is the molecular weight of 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol?
The molecular weight of 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol is 221.06 g/mol.
Where can I buy 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol?
You can request a quote for 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.