6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid
TL;DR: 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid (CAS 93982-53-7) is a chemical compound with molecular formula C30H18Cl2N4O8S2 and molecular weight 695.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-anilino-6,13-dichloro-3-phenylimino-7H-[1,4]benzoxazino[2,3-b]phenoxazine-2,9-disulfonic acid
Also Known As: DirectBlue106, Direct Blue 106, C.I. Direct Blue 106, Solophenyl Brilliant Blue BL, Sirius supra blue fgl-CF stain
| Molecular Formula | C30H18Cl2N4O8S2 |
|---|---|
| Molecular Weight | 695.99 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 193.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 695.9943 |
| Heavy Atoms | 46 |
| Complexity | 1530.0 |
Chemical Identifiers
| CAS Number | 93982-53-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C(C=C3C(=C2)OC4=C(C5=C(C(=C4N3)Cl)OC6=CC(=NC7=CC=CC=C7)C(=CC6=N5)S(=O)(=O)O)Cl)S(=O)(=O)O |
| InChIKey | UTJRJMAJHDKFNR-UHFFFAOYSA-N |
Product Overview
6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid (CAS 93982-53-7), with molecular formula C30H18Cl2N4O8S2 and molecular weight 695.99 g/mol. IUPAC: 10-anilino-6,13-dichloro-3-phenylimino-7H-[1,4]benzoxazino[2,3-b]phenoxazine-2,9-disulfonic acid.
Chemical Property Profile of 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid
Property Insights of 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid
The XLogP value of 5.5 indicates that 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 193.0 Ų indicates high polarity, suggesting 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid?
The CAS number of 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid is 93982-53-7.
What is the molecular formula of 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid?
The molecular formula of 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid is C30H18Cl2N4O8S2.
What is the molecular weight of 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid?
The molecular weight of 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid is 695.99 g/mol.
Where can I buy 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid?
You can request a quote for 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 6,13-Dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.