N-(1-Naphthyl)tetrabromophthalamic acid
TL;DR: N-(1-Naphthyl)tetrabromophthalamic acid (CAS 54914-90-8) is a chemical compound with molecular formula C18H9Br4NO3 and molecular weight 602.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5-tetrabromo-6-(naphthalen-1-ylcarbamoyl)benzoic acid
Also Known As: N-(1-NAPHTHYL)TETRABROMOPHTHALAMIC ACID, 2,3,4,5-tetrabromo-6-(naphthalen-1-ylcarbamoyl)benzoic acid, 2,3,4,5-Tetrabromo-6-[(naphthalen-1-yl)carbamoyl]benzoic acid, BENZOIC ACID,2,3,4,5-TETRABROMO-6-[(1-NAPHTHALENYLAMINO)CARBONYL]-, 667-815-7
| Molecular Formula | C18H9Br4NO3 |
|---|---|
| Molecular Weight | 602.73 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 602.73157 |
| Heavy Atoms | 26 |
| Complexity | 549.0 |
Chemical Identifiers
| CAS Number | 54914-90-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=C(C(=C(C(=C3Br)Br)Br)Br)C(=O)O |
| InChIKey | JWPBFQCSPZQAFH-UHFFFAOYSA-N |
Product Overview
N-(1-Naphthyl)tetrabromophthalamic acid (CAS 54914-90-8), with molecular formula C18H9Br4NO3 and molecular weight 602.73 g/mol. IUPAC: 2,3,4,5-tetrabromo-6-(naphthalen-1-ylcarbamoyl)benzoic acid.
Chemical Property Profile of N-(1-Naphthyl)tetrabromophthalamic acid
Property Insights of N-(1-Naphthyl)tetrabromophthalamic acid
The XLogP value of 5.6 indicates that N-(1-Naphthyl)tetrabromophthalamic 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 N-(1-Naphthyl)tetrabromophthalamic acid. Following Lipinski's Rule of Five, N-(1-Naphthyl)tetrabromophthalamic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(1-Naphthyl)tetrabromophthalamic acid?
The CAS number of N-(1-Naphthyl)tetrabromophthalamic acid is 54914-90-8.
What is the molecular formula of N-(1-Naphthyl)tetrabromophthalamic acid?
The molecular formula of N-(1-Naphthyl)tetrabromophthalamic acid is C18H9Br4NO3.
What is the molecular weight of N-(1-Naphthyl)tetrabromophthalamic acid?
The molecular weight of N-(1-Naphthyl)tetrabromophthalamic acid is 602.73 g/mol.
Where can I buy N-(1-Naphthyl)tetrabromophthalamic acid?
You can request a quote for N-(1-Naphthyl)tetrabromophthalamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-Naphthyl)tetrabromophthalamic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(1-Naphthyl)tetrabromophthalamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.