Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)-
TL;DR: Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)- (CAS 41169-10-2) is a chemical compound with molecular formula C16H12O4 and molecular weight 268.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-1-carboxy-2-phenylethenyl]benzoic acid
Also Known As: (E)-2-Carboxy-alpha-(phenylmethylene)benzeneacetic acid, Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)-, J3.505.549E, 2-((E)-1-Carboxy-2-phenylvinyl)benzoic acid, 2-[(1E)-1-carboxy-2-phenyleth-1-en-1-yl]benzoic acid
| Molecular Formula | C16H12O4 |
|---|---|
| Molecular Weight | 268.07 g/mol |
| LogP | 3.01 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.07355 |
| Heavy Atoms | 20 |
| Complexity | 671.88605 |
Chemical Identifiers
| CAS Number | 41169-10-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C(\C2=CC=CC=C2C(=O)O)/C(=O)O |
Product Overview
Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)- (CAS 41169-10-2), with molecular formula C16H12O4 and molecular weight 268.07 g/mol. IUPAC: 2-[(E)-1-carboxy-2-phenylethenyl]benzoic acid.
Chemical Property Profile of Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)-
Property Insights of Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)-
The XLogP value of 3.01 indicates that Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)-. Following Lipinski's Rule of Five, Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)- 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 Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)-?
The CAS number of Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)- is 41169-10-2.
What is the molecular formula of Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)-?
The molecular formula of Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)- is C16H12O4.
What is the molecular weight of Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)-?
The molecular weight of Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)- is 268.07 g/mol.
Where can I buy Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)-?
You can request a quote for Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetic acid, 2-carboxy-alpha-(phenylmethylene)-, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.