![2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid structure](/static/products/811/811841-53-9.png)
2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid
TL;DR: 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid (CAS 811841-53-9) is a chemical compound with molecular formula C16H13NO5 and molecular weight 299.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]acetic acid
Also Known As: 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid, 2-(2-(N-BENZO[3,4-D]1,3-DIOXOLEN-5-YLCARBAMOYL)PHENYL)ACETIC ACID, 2-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]acetic acid, 2-{2-[(1,3-benzodioxol-5-ylamino)carbonyl]phenyl}acetic acid, 2-{2-[(2H-1,3-benzodioxol-5-yl)carbamoyl]phenyl}acetic acid
| Molecular Formula | C16H13NO5 |
|---|---|
| Molecular Weight | 299.08 g/mol |
| LogP | 2.2947 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.07938 |
| Heavy Atoms | 22 |
| Complexity | 741.06604 |
Chemical Identifiers
| CAS Number | 811841-53-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=CC=C3CC(=O)O |
Product Overview
2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid (CAS 811841-53-9), with molecular formula C16H13NO5 and molecular weight 299.08 g/mol. IUPAC: 2-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]acetic acid.
Chemical Property Profile of 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid
Property Insights of 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid
The XLogP value of 2.2947 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid. Following Lipinski's Rule of Five, 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid has 2 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-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid?
The CAS number of 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid is 811841-53-9.
What is the molecular formula of 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid?
The molecular formula of 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid is C16H13NO5.
What is the molecular weight of 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid?
The molecular weight of 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid is 299.08 g/mol.
Where can I buy 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid?
You can request a quote for 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)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 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-(Benzo[d][1,3]dioxol-5-ylcarbamoyl)phenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.