(S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride
TL;DR: (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride (CAS 331847-07-5) is a chemical compound with molecular formula C10H9ClF5NO2 and molecular weight 305.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-amino-4-(2,3,4,5,6-pentafluorophenyl)butanoic acid;hydrochloride
Also Known As: H-Phe(F5)-OH HCl, (S)-3-AMINO-4-PENTAFLUOROPHENYLBUTANOIC ACID HYDROCHLORIDE, Pentafluoro-L-beta-homophenylalanine hydrochloride, 4424AH, (S)-3-amino-4-(perfluorophenyl)butanoic acid hydrochloride
| Molecular Formula | C10H9ClF5NO2 |
|---|---|
| Molecular Weight | 305.02 g/mol |
| LogP | 2.1484 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.0242 |
| Heavy Atoms | 19 |
| Complexity | 468.29373 |
Chemical Identifiers
| CAS Number | 331847-07-5 |
|---|---|
| SMILES | C(C1=C(C(=C(C(=C1F)F)F)F)F)[C@@H](CC(=O)O)N.Cl |
Product Overview
(S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride (CAS 331847-07-5), with molecular formula C10H9ClF5NO2 and molecular weight 305.02 g/mol. IUPAC: (3S)-3-amino-4-(2,3,4,5,6-pentafluorophenyl)butanoic acid;hydrochloride.
Chemical Property Profile of (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride
Property Insights of (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride
The XLogP value of 2.1484 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride. Following Lipinski's Rule of Five, (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride has 2 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 (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride?
The CAS number of (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride is 331847-07-5.
What is the molecular formula of (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride?
The molecular formula of (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride is C10H9ClF5NO2.
What is the molecular weight of (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride?
The molecular weight of (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride is 305.02 g/mol.
Where can I buy (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride?
You can request a quote for (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for (S)-3-Amino-4-pentafluorophenylbutanoic acid hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.