2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid
TL;DR: 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid (CAS 40136-89-8) is a chemical compound with molecular formula C18H19I2N3O2 and molecular weight 562.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-[bis(2-iodoethyl)amino]-2-methylphenyl]diazenyl]benzoic acid
Also Known As: Azobenzene, 4-bis(2-iodoethyl)amino-2'-carboxy-2-methyl-, 2-[[4-[bis(2-iodoethyl)amino]-2-methylphenyl]diazenyl]benzoic acid, Benzoic acid, 2-((4-bis(2-iodoethyl)amino)-1-(o-tolyl))azo-, BENZOIC ACID, 2-((4-BIS(2-IODOETHYL)AMINO-2-METHYL)PHENYL)AZO-, Benzoic acid, 2-[[4-[bis(2-iodoethyl)amino]-2-methylphenyl]azo]-
| Molecular Formula | C18H19I2N3O2 |
|---|---|
| Molecular Weight | 562.96 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 65.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 562.95667 |
| Heavy Atoms | 25 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 40136-89-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCI)CCI)N=NC2=CC=CC=C2C(=O)O |
| InChIKey | QFQHSEVSDPSZRN-UHFFFAOYSA-N |
Product Overview
2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid (CAS 40136-89-8), with molecular formula C18H19I2N3O2 and molecular weight 562.96 g/mol. IUPAC: 2-[[4-[bis(2-iodoethyl)amino]-2-methylphenyl]diazenyl]benzoic acid.
Chemical Property Profile of 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid
Property Insights of 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid
The XLogP value of 5.9 indicates that 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid. Following Lipinski's Rule of Five, 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid?
The CAS number of 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid is 40136-89-8.
What is the molecular formula of 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid?
The molecular formula of 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid is C18H19I2N3O2.
What is the molecular weight of 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid?
The molecular weight of 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid is 562.96 g/mol.
Where can I buy 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid?
You can request a quote for 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-(Bis(2-iodoethyl)amino)-2-methylphenyl)diazenyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.