3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde
TL;DR: 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde (CAS 116209-27-9) 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-methoxy-4-pyrrolidin-1-ylbenzaldehyde
Also Known As: 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde, 3-Methoxy-4-pyrrolidin-1-yl-benzaldehyde, 3-methoxy-4-pyrrolidin-1-ylbenzaldehyde, Benzaldehyde, 3-methoxy-4-(1-pyrrolidinyl)-, 3-methoxy-4-pyrrolidinylbenzaldehyde
| Molecular Formula | C12H15NO2 |
|---|---|
| Molecular Weight | 205.11 g/mol |
| LogP | 2.1079 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.11028 |
| Heavy Atoms | 15 |
| Complexity | 356.6398 |
Chemical Identifiers
| CAS Number | 116209-27-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=O)N2CCCC2 |
Product Overview
3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde (CAS 116209-27-9), with molecular formula C12H15NO2 and molecular weight 205.11 g/mol. IUPAC: 3-methoxy-4-pyrrolidin-1-ylbenzaldehyde.
Chemical Property Profile of 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde
Property Insights of 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde
The XLogP value of 2.1079 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde. With a topological polar surface area (TPSA) of 29.54 Ų, 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde 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 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde?
The CAS number of 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde is 116209-27-9.
What is the molecular formula of 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde?
The molecular formula of 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde is C12H15NO2.
What is the molecular weight of 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde?
The molecular weight of 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde is 205.11 g/mol.
Where can I buy 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde?
You can request a quote for 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-4-(pyrrolidin-1-yl)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.