3-(1,3-Dimethylpyrrolidin-3-yl)phenol
TL;DR: 3-(1,3-Dimethylpyrrolidin-3-yl)phenol (CAS 2093-29-0) is a chemical compound with molecular formula C12H17NO and molecular weight 191.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-dimethylpyrrolidin-3-yl)phenol
Also Known As: 3-(1,3-dimethylpyrrolidin-3-yl)phenol, m-(1,3-Dimethyl-3-pyrrolidinyl)phenol, Phenol, m-(1,3-dimethyl-3-pyrrolidinyl)-, 1,3-Dimethyl-3-(m-hydroxyphenyl)pyrrolidine, 3-(1,3-Dimethyl-3-pyrrolidinyl)phenol
| Molecular Formula | C12H17NO |
|---|---|
| Molecular Weight | 191.13 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.13101 |
| Heavy Atoms | 14 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 2093-29-0 |
|---|---|
| SMILES | CC1(CCN(C1)C)C2=CC(=CC=C2)O |
| InChIKey | WNFFIEOSTPUMGJ-UHFFFAOYSA-N |
Product Overview
3-(1,3-Dimethylpyrrolidin-3-yl)phenol (CAS 2093-29-0), with molecular formula C12H17NO and molecular weight 191.13 g/mol. IUPAC: 3-(1,3-dimethylpyrrolidin-3-yl)phenol.
Chemical Property Profile of 3-(1,3-Dimethylpyrrolidin-3-yl)phenol
Property Insights of 3-(1,3-Dimethylpyrrolidin-3-yl)phenol
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,3-Dimethylpyrrolidin-3-yl)phenol. With a topological polar surface area (TPSA) of 23.5 Ų, 3-(1,3-Dimethylpyrrolidin-3-yl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,3-Dimethylpyrrolidin-3-yl)phenol has 1 hydrogen bond donor(s) and 2 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-Dimethylpyrrolidin-3-yl)phenol?
The CAS number of 3-(1,3-Dimethylpyrrolidin-3-yl)phenol is 2093-29-0.
What is the molecular formula of 3-(1,3-Dimethylpyrrolidin-3-yl)phenol?
The molecular formula of 3-(1,3-Dimethylpyrrolidin-3-yl)phenol is C12H17NO.
What is the molecular weight of 3-(1,3-Dimethylpyrrolidin-3-yl)phenol?
The molecular weight of 3-(1,3-Dimethylpyrrolidin-3-yl)phenol is 191.13 g/mol.
Where can I buy 3-(1,3-Dimethylpyrrolidin-3-yl)phenol?
You can request a quote for 3-(1,3-Dimethylpyrrolidin-3-yl)phenol 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-Dimethylpyrrolidin-3-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-Dimethylpyrrolidin-3-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.