![2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one structure](/static/products/5685/568543-78-2.webp)
2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one
TL;DR: 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one (CAS 568543-78-2) is a chemical compound with molecular formula C11H14ClNO and molecular weight 211.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone
Also Known As: 2,4,6-Triprenyl-phenol, 1-(1-Allyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-chloro-ethanone, 2-Chloro-1-[2,5-dimethyl-1-(2-propen-1-yl)-1H-pyrrol-3-yl]ethanone, 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one, Ethanone, 2-chloro-1-[2,5-dimethyl-1-(2-propenyl)-1H-pyrrol-3-yl]- (9CI)
| Molecular Formula | C11H14ClNO |
|---|---|
| Molecular Weight | 211.08 g/mol |
| LogP | 2.71244 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 211.07639 |
| Heavy Atoms | 14 |
| Complexity | 365.6096 |
Chemical Identifiers
| CAS Number | 568543-78-2 |
|---|---|
| SMILES | CC1=CC(=C(N1CC=C)C)C(=O)CCl |
Product Overview
2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one (CAS 568543-78-2), with molecular formula C11H14ClNO and molecular weight 211.08 g/mol. IUPAC: 2-chloro-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone.
Chemical Property Profile of 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one
Property Insights of 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one
The XLogP value of 2.71244 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one. With a topological polar surface area (TPSA) of 22.0 Ų, 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one has 0 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-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one?
The CAS number of 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one is 568543-78-2.
What is the molecular formula of 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one?
The molecular formula of 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one is C11H14ClNO.
What is the molecular weight of 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one?
The molecular weight of 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one is 211.08 g/mol.
Where can I buy 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one?
You can request a quote for 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.