1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1)
TL;DR: 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1) (CAS 25843-70-3) is a chemical compound with molecular formula C13H20ClNO2 and molecular weight 257.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dimethoxyphenyl)methyl]pyrrolidine;hydrochloride
Also Known As: 1-Veratrylpyrrolidine hydrochloride, NIOSH/UY0889000, Pyrrolidine, 1-veratryl-, hydrochloride, 1-(3,4-Dimethoxybenzyl)pyrrolidine hydrochloride, 1,2-Diamino-3-(3,4-dimethoxy-phenyl)-propan
| Molecular Formula | C13H20ClNO2 |
|---|---|
| Molecular Weight | 257.12 g/mol |
| LogP | 2.7214 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.11826 |
| Heavy Atoms | 17 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 25843-70-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CN2CCCC2)OC.Cl |
| InChIKey | ZANQMSNCULSKGO-UHFFFAOYSA-N |
Product Overview
1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1) (CAS 25843-70-3), with molecular formula C13H20ClNO2 and molecular weight 257.12 g/mol. IUPAC: 1-[(3,4-dimethoxyphenyl)methyl]pyrrolidine;hydrochloride.
Chemical Property Profile of 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1)
Property Insights of 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1)
The XLogP value of 2.7214 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 21.7 Ų, 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1) 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 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1)?
The CAS number of 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1) is 25843-70-3.
What is the molecular formula of 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1)?
The molecular formula of 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1) is C13H20ClNO2.
What is the molecular weight of 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1)?
The molecular weight of 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1) is 257.12 g/mol.
Where can I buy 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1)?
You can request a quote for 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 1-((3,4-Dimethoxyphenyl)methyl)pyrrolidine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.