Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate
TL;DR: Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate (CAS 6527-70-4) is a chemical compound with molecular formula C30H16Cl2N4Na2O8S2 and molecular weight 739.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;10-anilino-6,13-dichloro-3-phenylimino-7H-[1,4]benzoxazino[2,3-b]phenoxazine-2,9-disulfonate
Also Known As: Direct Blue 106, Sirius supra blue fgl-CF stain, C.I. Direct Blue 106, Solophenyl Brilliant Blue BL, C.I. Direct Blue 106, disodium salt
| Molecular Formula | C30H16Cl2N4Na2O8S2 |
|---|---|
| Molecular Weight | 739.96 g/mol |
| LogP | 0.88 |
| Topological Polar Surface Area | 198.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 3 |
| Exact Mass | 739.9582 |
| Heavy Atoms | 48 |
| Complexity | 1500.0 |
Chemical Identifiers
| CAS Number | 6527-70-4 |
|---|---|
| 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-].[Na+].[Na+] |
| InChIKey | GRTBLYIRBPEDPE-UHFFFAOYSA-L |
Product Overview
Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate (CAS 6527-70-4), with molecular formula C30H16Cl2N4Na2O8S2 and molecular weight 739.96 g/mol. IUPAC: disodium;10-anilino-6,13-dichloro-3-phenylimino-7H-[1,4]benzoxazino[2,3-b]phenoxazine-2,9-disulfonate.
Chemical Property Profile of Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate
Property Insights of Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate
The XLogP value of 0.88 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate. The TPSA of 198.0 Ų indicates high polarity, suggesting Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate has 2 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 Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate?
The CAS number of Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate is 6527-70-4.
What is the molecular formula of Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate?
The molecular formula of Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate is C30H16Cl2N4Na2O8S2.
What is the molecular weight of Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate?
The molecular weight of Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate is 739.96 g/mol.
Where can I buy Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate?
You can request a quote for Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate?
Yes, KEHONG BIO provides custom synthesis services for Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.