Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride
TL;DR: Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride (CAS 27452-86-4) is a chemical compound with molecular formula C22H30ClNO2 and molecular weight 375.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-butyl-1-[2-(4-hydroxyphenyl)ethyl]pyrrolidin-3-yl]phenol;hydrochloride
Also Known As: Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride, Pyrrolidine, 3-butyl-1-(p-hydroxyphenethyl)3-(m-hydroxyphenyl)-, hydrochloride, Phenol, m-[3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl]-, hydrochloride, 3-[3-butyl-1-[2-(4-hydroxyphenyl)ethyl]pyrrolidin-3-yl]phenol hydrochloride, 3-{3-Butyl-1-[2-(4-hydroxyphenyl)ethyl]pyrrolidin-3-yl}phenol--hydrogen chloride (1/1)
| Molecular Formula | C22H30ClNO2 |
|---|---|
| Molecular Weight | 375.20 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 375.1965 |
| Heavy Atoms | 26 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 27452-86-4 |
|---|---|
| SMILES | CCCCC1(CCN(C1)CCC2=CC=C(C=C2)O)C3=CC(=CC=C3)O.Cl |
| InChIKey | IZXBSVGEPHPPMJ-UHFFFAOYSA-N |
Product Overview
Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride (CAS 27452-86-4), with molecular formula C22H30ClNO2 and molecular weight 375.20 g/mol. IUPAC: 3-[3-butyl-1-[2-(4-hydroxyphenyl)ethyl]pyrrolidin-3-yl]phenol;hydrochloride.
Chemical Property Profile of Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride
Property Insights of Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride
The XLogP value of 4.9 indicates that Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride has 3 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-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride?
The CAS number of Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride is 27452-86-4.
What is the molecular formula of Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride?
The molecular formula of Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride is C22H30ClNO2.
What is the molecular weight of Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride?
The molecular weight of Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride is 375.20 g/mol.
Where can I buy Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride?
You can request a quote for Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-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-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Phenol, m-(3-butyl-1-(p-hydroxyphenethyl)-3-pyrrolidinyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.