5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one
TL;DR: 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one (CAS 160295-41-0) is a chemical compound with molecular formula C9H12ClNO and molecular weight 185.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one
Also Known As: 3-(5-chloropentanoyl)-1H-pyrrole, 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one, 5-Chloro-1-(1H-pyrrol-3-yl)-1-pentanone
| Molecular Formula | C9H12ClNO |
|---|---|
| Molecular Weight | 185.06 g/mol |
| LogP | 2.6065 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 185.06075 |
| Heavy Atoms | 12 |
| Complexity | 230.68639 |
Chemical Identifiers
| CAS Number | 160295-41-0 |
|---|---|
| SMILES | C1=CNC=C1C(=O)CCCCCl |
Product Overview
5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one (CAS 160295-41-0), with molecular formula C9H12ClNO and molecular weight 185.06 g/mol. IUPAC: 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one.
Chemical Property Profile of 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one
Property Insights of 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one
The XLogP value of 2.6065 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one. With a topological polar surface area (TPSA) of 32.86 Ų, 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one 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 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one?
The CAS number of 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one is 160295-41-0.
What is the molecular formula of 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one?
The molecular formula of 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one is C9H12ClNO.
What is the molecular weight of 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one?
The molecular weight of 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one is 185.06 g/mol.
Where can I buy 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one?
You can request a quote for 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-1-(1H-pyrrol-3-yl)pentan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.