3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1)
TL;DR: 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1) (CAS 16220-85-2) is a chemical compound with molecular formula C11H14ClNO5 and molecular weight 275.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-amino-2-carboxyethyl)-2-methoxybenzoic acid;hydrochloride
Also Known As: DL-alpha-Amino-3-carboxy-2-methoxyhydrocinnamic acid hydrochloride, 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1), Hydrocinnamic acid, alpha-amino-3-carboxy-2-methoxy HCl, Hydrocinnamic acid, alpha-amino-3-carboxy-2-methoxy-, hydrochloride, DL-, 3-(2-amino-2-carboxyethyl)-2-methoxybenzoic acid,hydrochloride
| Molecular Formula | C11H14ClNO5 |
|---|---|
| Molecular Weight | 275.06 g/mol |
| LogP | 0.77 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.05606 |
| Heavy Atoms | 18 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 16220-85-2 |
|---|---|
| SMILES | COC1=C(C=CC=C1C(=O)O)CC(C(=O)O)N.Cl |
| InChIKey | ZNBIZHGGHUJJFY-UHFFFAOYSA-N |
Product Overview
3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1) (CAS 16220-85-2), with molecular formula C11H14ClNO5 and molecular weight 275.06 g/mol. IUPAC: 3-(2-amino-2-carboxyethyl)-2-methoxybenzoic acid;hydrochloride.
Chemical Property Profile of 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1)
Property Insights of 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1)
The XLogP value of 0.77 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1). The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1). Following Lipinski's Rule of Five, 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1) has 4 hydrogen bond donor(s) and 6 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 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1)?
The CAS number of 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1) is 16220-85-2.
What is the molecular formula of 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1)?
The molecular formula of 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1) is C11H14ClNO5.
What is the molecular weight of 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1)?
The molecular weight of 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1) is 275.06 g/mol.
Where can I buy 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1)?
You can request a quote for 3-Carboxy-2-methoxyphenylalanine--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 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 3-Carboxy-2-methoxyphenylalanine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.