Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane-
TL;DR: Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane- (CAS 40259-14-1) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-methylspiro[1,3-benzodioxole-2,3'-pyrrolidine]
Also Known As: 1'-methyl-spiro[benzo[1,3]dioxole-2,3'-pyrrolidine], Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane-, 1'-methylspiro[1,3-benzodioxole-2,3'-pyrrolidine]
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 40259-14-1 |
|---|---|
| SMILES | CN1CCC2(C1)OC3=CC=CC=C3O2 |
| InChIKey | APZDXXRZAVORTA-UHFFFAOYSA-N |
Product Overview
Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane- (CAS 40259-14-1), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: 1'-methylspiro[1,3-benzodioxole-2,3'-pyrrolidine].
Chemical Property Profile of Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane-
Property Insights of Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane-. With a topological polar surface area (TPSA) of 21.7 Ų, Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane- has 0 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 Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane-?
The CAS number of Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane- is 40259-14-1.
What is the molecular formula of Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane-?
The molecular formula of Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane- is C11H13NO2.
What is the molecular weight of Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane-?
The molecular weight of Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane- is 191.09 g/mol.
Where can I buy Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane-?
You can request a quote for Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 1-methyl-3,2'-spiro-benzo-1,3-dioxolane- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.