Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride
TL;DR: Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride (CAS 5048-25-9) is a chemical compound with molecular formula C14H20ClNO2 and molecular weight 269.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(3-hydroxyphenyl)-1-methylpyrrolidin-3-yl]propan-1-one;hydrochloride
Also Known As: starbld0035922, Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride, m-(1-Methyl-3-propionyl-3-pyrrolidinyl)phenol hydrochloride, 1-[3-(3-hydroxyphenyl)-1-methylpyrrolidin-3-yl]propan-1-one hydrochloride(1:1), Pyrrolidine, 1-methyl-3-(m-hydroxyphenyl)-3-propionyl-, hydrochloride
| Molecular Formula | C14H20ClNO2 |
|---|---|
| Molecular Weight | 269.12 g/mol |
| LogP | 2.3664 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.11826 |
| Heavy Atoms | 18 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 5048-25-9 |
|---|---|
| SMILES | CCC(=O)C1(CCN(C1)C)C2=CC(=CC=C2)O.Cl |
| InChIKey | AWPOUXABCFQXJC-UHFFFAOYSA-N |
Product Overview
Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride (CAS 5048-25-9), with molecular formula C14H20ClNO2 and molecular weight 269.12 g/mol. IUPAC: 1-[3-(3-hydroxyphenyl)-1-methylpyrrolidin-3-yl]propan-1-one;hydrochloride.
Chemical Property Profile of Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride
Property Insights of Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride
The XLogP value of 2.3664 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride. With a topological polar surface area (TPSA) of 40.5 Ų, Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride has 2 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 Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride?
The CAS number of Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride is 5048-25-9.
What is the molecular formula of Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride?
The molecular formula of Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride is C14H20ClNO2.
What is the molecular weight of Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride?
The molecular weight of Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride is 269.12 g/mol.
Where can I buy Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride?
You can request a quote for Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Phenol, m-(1-methyl-3-propionyl-3-pyrrolidinyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.