N-(2-苯乙基)天冬氨酸
TL;DR: N-(2-苯乙基)天冬氨酸 (CAS 5872-49-1) is a chemical compound with molecular formula C12H15NO4 and molecular weight 237.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-苯乙基)天冬氨酸
2-(2-phenylethylamino)butanedioic acid
Also Known As: DL-N-Phenethylaspartic acid, N-(2-phenylethyl)aspartic acid, Acido N-fenetil-DL-aspartico, 2-(2-phenylethylamino)butanedioic acid, Acido N-fenetil-DL-aspartico [Italian]
| Molecular Formula | C12H15NO4 |
|---|---|
| Molecular Weight | 237.10 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 237.10011 |
| Heavy Atoms | 17 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 5872-49-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC(CC(=O)O)C(=O)O |
| InChIKey | MUCWEAHFBIHWCX-UHFFFAOYSA-N |
Product Overview
N-(2-苯乙基)天冬氨酸 (CAS 5872-49-1), with molecular formula C12H15NO4 and molecular weight 237.10 g/mol. IUPAC: 2-(2-phenylethylamino)butanedioic acid.
Chemical Property Profile of N-(2-苯乙基)天冬氨酸
Property Insights of N-(2-苯乙基)天冬氨酸
The XLogP value of -1.4 indicates that N-(2-苯乙基)天冬氨酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-苯乙基)天冬氨酸. Following Lipinski's Rule of Five, N-(2-苯乙基)天冬氨酸 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 N-(2-苯乙基)天冬氨酸?
The CAS number of N-(2-苯乙基)天冬氨酸 is 5872-49-1.
What is the molecular formula of N-(2-苯乙基)天冬氨酸?
The molecular formula of N-(2-苯乙基)天冬氨酸 is C12H15NO4.
What is the molecular weight of N-(2-苯乙基)天冬氨酸?
The molecular weight of N-(2-苯乙基)天冬氨酸 is 237.10 g/mol.
Where can I buy N-(2-苯乙基)天冬氨酸?
You can request a quote for N-(2-苯乙基)天冬氨酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-苯乙基)天冬氨酸?
Yes, KEHONG BIO provides custom synthesis services for N-(2-苯乙基)天冬氨酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.