![(2E)-3-[3-(benzoylamino)phenyl]acrylic acid structure](/static/products/1165/116557-36-9.webp)
(2E)-3-[3-(benzoylamino)phenyl]acrylic acid
TL;DR: (2E)-3-[3-(benzoylamino)phenyl]acrylic acid (CAS 116557-36-9) is a chemical compound with molecular formula C16H13NO3 and molecular weight 267.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3-benzamidophenyl)prop-2-enoic acid
Also Known As: IFLab1_000054, (2E)-3-[3-(benzoylamino)phenyl]acrylic acid, (E)-3-(3-benzamidophenyl)acrylic acid, 3-[3-(Benzoylamino)phenyl]acrylic acid, IDI1_008273
| Molecular Formula | C16H13NO3 |
|---|---|
| Molecular Weight | 267.09 g/mol |
| LogP | 3.0367 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 267.08954 |
| Heavy Atoms | 20 |
| Complexity | 647.7814 |
Chemical Identifiers
| CAS Number | 116557-36-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)/C=C/C(=O)O |
Product Overview
(2E)-3-[3-(benzoylamino)phenyl]acrylic acid (CAS 116557-36-9), with molecular formula C16H13NO3 and molecular weight 267.09 g/mol. IUPAC: (E)-3-(3-benzamidophenyl)prop-2-enoic acid.
Chemical Property Profile of (2E)-3-[3-(benzoylamino)phenyl]acrylic acid
Property Insights of (2E)-3-[3-(benzoylamino)phenyl]acrylic acid
The XLogP value of 3.0367 indicates that (2E)-3-[3-(benzoylamino)phenyl]acrylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-[3-(benzoylamino)phenyl]acrylic acid. Following Lipinski's Rule of Five, (2E)-3-[3-(benzoylamino)phenyl]acrylic acid has 2 hydrogen bond donor(s) and 2 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 (2E)-3-[3-(benzoylamino)phenyl]acrylic acid?
The CAS number of (2E)-3-[3-(benzoylamino)phenyl]acrylic acid is 116557-36-9.
What is the molecular formula of (2E)-3-[3-(benzoylamino)phenyl]acrylic acid?
The molecular formula of (2E)-3-[3-(benzoylamino)phenyl]acrylic acid is C16H13NO3.
What is the molecular weight of (2E)-3-[3-(benzoylamino)phenyl]acrylic acid?
The molecular weight of (2E)-3-[3-(benzoylamino)phenyl]acrylic acid is 267.09 g/mol.
Where can I buy (2E)-3-[3-(benzoylamino)phenyl]acrylic acid?
You can request a quote for (2E)-3-[3-(benzoylamino)phenyl]acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-[3-(benzoylamino)phenyl]acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-[3-(benzoylamino)phenyl]acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.