2-Phenylmethoxyiminobutanoic acid
TL;DR: 2-Phenylmethoxyiminobutanoic acid (CAS 5435-45-0) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylmethoxyiminobutanoic acid
Also Known As: 2-phenylmethoxyiminobutanoic acid, 2-[(benzyloxy)imino]butanoic acid, (2E)-2-PHENYLMETHOXYIMINOBUTANOIC ACID, 2-(2,4,7-trimethyl-1H-indol-3-yl)acetic acid
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 5435-45-0 |
|---|---|
| SMILES | CCC(=NOCC1=CC=CC=C1)C(=O)O |
| InChIKey | XMAAOPAZUBODOG-UHFFFAOYSA-N |
Product Overview
2-Phenylmethoxyiminobutanoic acid (CAS 5435-45-0), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: 2-phenylmethoxyiminobutanoic acid.
Chemical Property Profile of 2-Phenylmethoxyiminobutanoic acid
Property Insights of 2-Phenylmethoxyiminobutanoic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenylmethoxyiminobutanoic acid. With a topological polar surface area (TPSA) of 58.9 Ų, 2-Phenylmethoxyiminobutanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenylmethoxyiminobutanoic acid has 1 hydrogen bond donor(s) and 4 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 2-Phenylmethoxyiminobutanoic acid?
The CAS number of 2-Phenylmethoxyiminobutanoic acid is 5435-45-0.
What is the molecular formula of 2-Phenylmethoxyiminobutanoic acid?
The molecular formula of 2-Phenylmethoxyiminobutanoic acid is C11H13NO3.
What is the molecular weight of 2-Phenylmethoxyiminobutanoic acid?
The molecular weight of 2-Phenylmethoxyiminobutanoic acid is 207.09 g/mol.
Where can I buy 2-Phenylmethoxyiminobutanoic acid?
You can request a quote for 2-Phenylmethoxyiminobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenylmethoxyiminobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenylmethoxyiminobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.