![[2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate structure](/static/products/6252/62522-80-9.webp)
[2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate
TL;DR: [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate (CAS 62522-80-9) is a chemical compound with molecular formula C19H20ClNO4 and molecular weight 361.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate
Also Known As: [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate|[2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrro|[5-(4-Chlorophenyl)-2,3-dihydro-1H-pyrrolizine-6,7-diyl]bis(methylene) diacetate
| Molecular Formula | C19H20ClNO4 |
|---|---|
| Molecular Weight | 361.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 361.1081 |
| Heavy Atoms | 25 |
| Complexity | 492.0 |
Chemical Identifiers
| CAS Number | 62522-80-9 |
|---|---|
| SMILES | CC(=O)OCC1=C2CCCN2C(=C1COC(=O)C)C3=CC=C(C=C3)Cl |
| InChIKey | CTCSNPLKHGGMKP-UHFFFAOYSA-N |
Product Overview
[2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate (CAS 62522-80-9), with molecular formula C19H20ClNO4 and molecular weight 361.11 g/mol. IUPAC: [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate.
Chemical Property Profile of [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate
Property Insights of [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate. With a topological polar surface area (TPSA) of 57.5 Ų, [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate has 0 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 [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate?
The CAS number of [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate is 62522-80-9.
What is the molecular formula of [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate?
The molecular formula of [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate is C19H20ClNO4.
What is the molecular weight of [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate?
The molecular weight of [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate is 361.11 g/mol.
Where can I buy [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate?
You can request a quote for [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for [2-(acetyloxymethyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.