![6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline] structure](/static/products/113/113312-17-7.png)
6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline]
TL;DR: 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline] (CAS 113312-17-7) is a chemical compound with molecular formula C19H16BrN3O5 and molecular weight 445.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indole]
Also Known As: BAS 01057014, 6-bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indole], 6-bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline], 6-bromo-11,13,13-trimethyl-8,15-dinitrospiro[2H-chromene-2,2'-indoline], 6-bromo-1',3',3'-trimethyl-5',8-dinitro-1',3'-dihydrospiro[chromene-2,2'-indole]
| Molecular Formula | C19H16BrN3O5 |
|---|---|
| Molecular Weight | 445.03 g/mol |
| LogP | 4.795 |
| Topological Polar Surface Area | 98.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 445.02734 |
| Heavy Atoms | 28 |
| Complexity | 1081.479 |
Chemical Identifiers
| CAS Number | 113312-17-7 |
|---|---|
| SMILES | CC1(C2=C(C=CC(=C2)[N+](=O)[O-])N(C13C=CC4=C(O3)C(=CC(=C4)Br)[N+](=O)[O-])C)C |
Product Overview
6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline] (CAS 113312-17-7), with molecular formula C19H16BrN3O5 and molecular weight 445.03 g/mol. IUPAC: 6-bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indole].
Chemical Property Profile of 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline]
Property Insights of 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline]
The XLogP value of 4.795 indicates that 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline]. Following Lipinski's Rule of Five, 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline] has 0 hydrogen bond donor(s) and 6 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 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline]?
The CAS number of 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline] is 113312-17-7.
What is the molecular formula of 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline]?
The molecular formula of 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline] is C19H16BrN3O5.
What is the molecular weight of 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline]?
The molecular weight of 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline] is 445.03 g/mol.
Where can I buy 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline]?
You can request a quote for 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline]?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-1',3',3'-trimethyl-5',8-dinitrospiro[chromene-2,2'-indoline] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.