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[(Dichloroacetyl)amino](phenyl)acetic acid
TL;DR: [(Dichloroacetyl)amino](phenyl)acetic acid (CAS 89315-22-0) is a chemical compound with molecular formula C10H9Cl2NO3 and molecular weight 261.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,2-dichloroacetyl)amino]-2-phenylacetic acid
Also Known As: [(dichloroacetyl)amino](phenyl)acetic acid|KST-1A8742|2-[(2,2-dichloroacetyl)amino]-2-phenylacetic acid|(2,2-DICHLOROACETAMIDO)(PHENYL)ACETIC ACID
| Molecular Formula | C10H9Cl2NO3 |
|---|---|
| Molecular Weight | 261.00 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.99594 |
| Heavy Atoms | 16 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 89315-22-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C(=O)O)NC(=O)C(Cl)Cl |
| InChIKey | RWFMAOOBMAQUMV-UHFFFAOYSA-N |
Product Overview
[(Dichloroacetyl)amino](phenyl)acetic acid (CAS 89315-22-0), with molecular formula C10H9Cl2NO3 and molecular weight 261.00 g/mol. IUPAC: 2-[(2,2-dichloroacetyl)amino]-2-phenylacetic acid.
Chemical Property Profile of [(Dichloroacetyl)amino](phenyl)acetic acid
Property Insights of [(Dichloroacetyl)amino](phenyl)acetic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(Dichloroacetyl)amino](phenyl)acetic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [(Dichloroacetyl)amino](phenyl)acetic acid. Following Lipinski's Rule of Five, [(Dichloroacetyl)amino](phenyl)acetic acid has 2 hydrogen bond donor(s) and 3 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 [(Dichloroacetyl)amino](phenyl)acetic acid?
The CAS number of [(Dichloroacetyl)amino](phenyl)acetic acid is 89315-22-0.
What is the molecular formula of [(Dichloroacetyl)amino](phenyl)acetic acid?
The molecular formula of [(Dichloroacetyl)amino](phenyl)acetic acid is C10H9Cl2NO3.
What is the molecular weight of [(Dichloroacetyl)amino](phenyl)acetic acid?
The molecular weight of [(Dichloroacetyl)amino](phenyl)acetic acid is 261.00 g/mol.
Where can I buy [(Dichloroacetyl)amino](phenyl)acetic acid?
You can request a quote for [(Dichloroacetyl)amino](phenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(Dichloroacetyl)amino](phenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(Dichloroacetyl)amino](phenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.