4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1)
TL;DR: 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1) (CAS 970-34-3) is a chemical compound with molecular formula C20H24ClNO and molecular weight 329.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-diphenyl-1-pyrrolidin-1-ium-1-ylbutan-2-one chloride
Also Known As: 4,4-Diphenyl-1-(1-pyrrolidinyl)-2-butanone hydrochloride, 4,4-diphenyl-1-pyrrolidin-1-ium-1-ylbutan-2-one chloride, 2-BUTANONE, 4,4-DIPHENYL-1-(1-PYRROLIDINYL)-, HYDROCHLORIDE, 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1), RefChem:1069346
| Molecular Formula | C20H24ClNO |
|---|---|
| Molecular Weight | 329.15 g/mol |
| LogP | -0.54 |
| Topological Polar Surface Area | 21.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 329.15463 |
| Heavy Atoms | 23 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 970-34-3 |
|---|---|
| SMILES | C1CC[NH+](C1)CC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-] |
| InChIKey | HLRRMTLQXSOLKO-UHFFFAOYSA-N |
Product Overview
4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1) (CAS 970-34-3), with molecular formula C20H24ClNO and molecular weight 329.15 g/mol. IUPAC: 4,4-diphenyl-1-pyrrolidin-1-ium-1-ylbutan-2-one chloride.
Chemical Property Profile of 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1)
Property Insights of 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1)
The XLogP value of -0.54 indicates that 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 21.5 Ų, 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1) 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 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1)?
The CAS number of 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1) is 970-34-3.
What is the molecular formula of 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1)?
The molecular formula of 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1) is C20H24ClNO.
What is the molecular weight of 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1)?
The molecular weight of 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1) is 329.15 g/mol.
Where can I buy 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1)?
You can request a quote for 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Diphenyl-1-(pyrrolidin-1-yl)butan-2-one--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.