![3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine structure](/static/products/911/911194-10-0.png)
3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine
TL;DR: 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine (CAS 911194-10-0) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-ylmethyl)pyrrolidine
Also Known As: 3-[(1,3-dioxaindan-5-yl)methyl]pyrrolidine, 3-(1,3-benzodioxol-5-ylmethyl)pyrrolidine, 3-(1,3-BENZODIOXOL-5-YLMETHYL)-PYRROLIDINE
| Molecular Formula | C12H15NO2 |
|---|---|
| Molecular Weight | 205.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 30.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.11028 |
| Heavy Atoms | 15 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 911194-10-0 |
|---|---|
| SMILES | C1CNCC1CC2=CC3=C(C=C2)OCO3 |
| InChIKey | SJLJMWBKBITYLC-UHFFFAOYSA-N |
Product Overview
3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine (CAS 911194-10-0), with molecular formula C12H15NO2 and molecular weight 205.11 g/mol. IUPAC: 3-(1,3-benzodioxol-5-ylmethyl)pyrrolidine.
Chemical Property Profile of 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine
Property Insights of 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine. With a topological polar surface area (TPSA) of 30.5 Ų, 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine has 1 hydrogen bond donor(s) and 3 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 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine?
The CAS number of 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine is 911194-10-0.
What is the molecular formula of 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine?
The molecular formula of 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine is C12H15NO2.
What is the molecular weight of 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine?
The molecular weight of 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine is 205.11 g/mol.
Where can I buy 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine?
You can request a quote for 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 3-[(1,3-Dioxaindan-5-yl)methyl]pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.