Phenyldehydroalanine
TL;DR: Phenyldehydroalanine (CAS 7060-39-1) is a chemical compound with molecular formula C9H9NO2 and molecular weight 163.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-amino-3-phenylprop-2-enoic acid
Also Known As: Phenyldehydroalanine, Dehydrophenylalanine, alpha-Aminocinnamate, 2,3-Didehydrophenylalanine, 2-Benzylideneglycine
| Molecular Formula | C9H9NO2 |
|---|---|
| Molecular Weight | 163.06 g/mol |
| LogP | 1.0708 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.06332 |
| Heavy Atoms | 12 |
| Complexity | 303.5644 |
Chemical Identifiers
| CAS Number | 7060-39-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C(/C(=O)O)\N |
Product Overview
Phenyldehydroalanine (CAS 7060-39-1), with molecular formula C9H9NO2 and molecular weight 163.06 g/mol. IUPAC: (Z)-2-amino-3-phenylprop-2-enoic acid.
Chemical Property Profile of Phenyldehydroalanine
Property Insights of Phenyldehydroalanine
The XLogP value of 1.0708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyldehydroalanine. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenyldehydroalanine. Following Lipinski's Rule of Five, Phenyldehydroalanine 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 Phenyldehydroalanine?
The CAS number of Phenyldehydroalanine is 7060-39-1.
What is the molecular formula of Phenyldehydroalanine?
The molecular formula of Phenyldehydroalanine is C9H9NO2.
What is the molecular weight of Phenyldehydroalanine?
The molecular weight of Phenyldehydroalanine is 163.06 g/mol.
Where can I buy Phenyldehydroalanine?
You can request a quote for Phenyldehydroalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyldehydroalanine?
Yes, KEHONG BIO provides custom synthesis services for Phenyldehydroalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.