3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1)
TL;DR: 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1) (CAS 51912-15-3) is a chemical compound with molecular formula C10H14ClNO4 and molecular weight 247.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-carboxy-2-(3,4-dihydroxyphenyl)ethyl]-methylazanium chloride
Also Known As: L-Dopa-N-methyl ester hydrochloride, 3,4-Dihydroxyphenyl-L-alanine-N-methyl ester hydrochloride, L-Tyrosine, 3-hydroxy-N-methyl-, hydrochloride, ALANINE, 3-(3,4-DIHYDROXYPHENYL)-N-METHYL-, HYDROCHLORIDE, L-, 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1)
| Molecular Formula | C10H14ClNO4 |
|---|---|
| Molecular Weight | 247.06 g/mol |
| LogP | -3.71 |
| Topological Polar Surface Area | 94.4 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 247.06114 |
| Heavy Atoms | 16 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 51912-15-3 |
|---|---|
| SMILES | C[NH2+]C(CC1=CC(=C(C=C1)O)O)C(=O)O.[Cl-] |
| InChIKey | WUBSGPKNROVQMZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1) (CAS 51912-15-3), with molecular formula C10H14ClNO4 and molecular weight 247.06 g/mol. IUPAC: [1-carboxy-2-(3,4-dihydroxyphenyl)ethyl]-methylazanium chloride.
Chemical Property Profile of 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1)
Property Insights of 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1)
The XLogP value of -3.71 indicates that 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 94.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1). Following Lipinski's Rule of Five, 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1) has 4 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 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1)?
The CAS number of 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1) is 51912-15-3.
What is the molecular formula of 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1)?
The molecular formula of 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1) is C10H14ClNO4.
What is the molecular weight of 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1)?
The molecular weight of 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1) is 247.06 g/mol.
Where can I buy 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1)?
You can request a quote for 3-Hydroxy-N-methyltyrosine--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-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-N-methyltyrosine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.