Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride
TL;DR: Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride (CAS 64-60-8) is a chemical compound with molecular formula C20H29ClFNO and molecular weight 353.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-azaspiro[5.5]undecan-3-yl)-1-(4-fluorophenyl)butan-1-one;hydrochloride
Also Known As: BUTYROPHENONE, 4-(3-AZASPIRO(5.5)UNDEC-3-YL)-4'-FLUORO-, HYDROCHLORIDE, 4-(3-Azaspiro(5.5)undec-3-yl)-4'-fluoro-butyrophenone hydrochloride, 3-((4-p-Fluorophenyl-4-hydroxy)butyl)-3-azaspiro(5.5)undecane hydrochloride, 4-(3-azaspiro[5.5]undec-3-yl)-1-(4-fluorophenyl)butan-1-one hydrochloride(1:1), 4-(3-azaspiro[5.5]undecan-3-yl)-1-(4-fluorophenyl)butan-1-on
| Molecular Formula | C20H29ClFNO |
|---|---|
| Molecular Weight | 353.19 g/mol |
| LogP | 5.26 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.19217 |
| Heavy Atoms | 24 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 64-60-8 |
|---|---|
| SMILES | C1CCC2(CC1)CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F.Cl |
| InChIKey | OOSPTPAVGQFOIZ-UHFFFAOYSA-N |
Product Overview
Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride (CAS 64-60-8), with molecular formula C20H29ClFNO and molecular weight 353.19 g/mol. IUPAC: 4-(3-azaspiro[5.5]undecan-3-yl)-1-(4-fluorophenyl)butan-1-one;hydrochloride.
Chemical Property Profile of Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride
Property Insights of Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride
The XLogP value of 5.26 indicates that Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride?
The CAS number of Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride is 64-60-8.
What is the molecular formula of Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride?
The molecular formula of Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride is C20H29ClFNO.
What is the molecular weight of Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride?
The molecular weight of Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride is 353.19 g/mol.
Where can I buy Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride?
You can request a quote for Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Butyrophenone, 4-(3-azaspiro(5.5)undec-3-yl)-4'-fluoro-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.