3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride
TL;DR: 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride (CAS 1049697-98-4) is a chemical compound with molecular formula C11H13ClF3NO and molecular weight 267.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(trifluoromethyl)phenyl]pyrrolidin-3-ol;hydrochloride
Also Known As: starbld0020647, 3-(4-(trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride, 3-[4-(trifluoromethyl)phenyl]pyrrolidin-3-ol hydrochloride, 3-(alpha,alpha,alpha-Trifluoro-m-tolyl)-3-pyrrolidinol hydrochloride, 3-[4-(trifluoromethyl)phenyl]pyrrolidin-3-ol;hydrochloride
| Molecular Formula | C11H13ClF3NO |
|---|---|
| Molecular Weight | 267.06 g/mol |
| LogP | 2.31 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 267.06378 |
| Heavy Atoms | 17 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 1049697-98-4 |
|---|---|
| SMILES | C1CNCC1(C2=CC=C(C=C2)C(F)(F)F)O.Cl |
| InChIKey | CCMJKBIBIGSUIZ-UHFFFAOYSA-N |
Product Overview
3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride (CAS 1049697-98-4), with molecular formula C11H13ClF3NO and molecular weight 267.06 g/mol. IUPAC: 3-[4-(trifluoromethyl)phenyl]pyrrolidin-3-ol;hydrochloride.
Chemical Property Profile of 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride
Property Insights of 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride
The XLogP value of 2.31 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride. With a topological polar surface area (TPSA) of 32.3 Ų, 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride has 3 hydrogen bond donor(s) and 5 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-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride?
The CAS number of 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride is 1049697-98-4.
What is the molecular formula of 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride?
The molecular formula of 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride is C11H13ClF3NO.
What is the molecular weight of 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride?
The molecular weight of 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride is 267.06 g/mol.
Where can I buy 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride?
You can request a quote for 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.