1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)-
TL;DR: 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)- (CAS 92302-28-8) is a chemical compound with molecular formula C14H18Cl2N2O2 and molecular weight 316.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-6-[bis(2-chloroethyl)amino]-2,3-dihydroindene-1-carboxylic acid
Also Known As: 1H-Indene-1-carboxylic acid,3-dihydro-, 1-Amino-6-(bis(2-chloroethyl)amino)-1-indancarboxylic acid, 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)-, 1-amino-6-[bis(2-chloroethyl)amino]-2,3-dihydroindene-1-carb, 1H-Indene-1-carboxylic acid, 1-amino-6-[bis(2-chloroethyl)amino]-2,3-dihydro-
| Molecular Formula | C14H18Cl2N2O2 |
|---|---|
| Molecular Weight | 316.07 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.07452 |
| Heavy Atoms | 20 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 92302-28-8 |
|---|---|
| SMILES | C1CC(C2=C1C=CC(=C2)N(CCCl)CCCl)(C(=O)O)N |
| InChIKey | QLKHYVQCWFFGNT-UHFFFAOYSA-N |
Product Overview
1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)- (CAS 92302-28-8), with molecular formula C14H18Cl2N2O2 and molecular weight 316.07 g/mol. IUPAC: 1-amino-6-[bis(2-chloroethyl)amino]-2,3-dihydroindene-1-carboxylic acid.
Chemical Property Profile of 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)-
Property Insights of 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)-
The XLogP value of -0.2 indicates that 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)-. Following Lipinski's Rule of Five, 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)- 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 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)-?
The CAS number of 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)- is 92302-28-8.
What is the molecular formula of 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)-?
The molecular formula of 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)- is C14H18Cl2N2O2.
What is the molecular weight of 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)-?
The molecular weight of 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)- is 316.07 g/mol.
Where can I buy 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)-?
You can request a quote for 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Indancarboxylic acid, 1-amino-6-(bis(2-chloroethyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.