C.I.Vat Blue 7
TL;DR: C.I.Vat Blue 7 (CAS 5637-01-4) is a chemical compound with molecular formula C36H16O2S2 and molecular weight 544.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(13Z)-13-(8-oxo-14-thiapentacyclo[10.5.2.02,7.09,18.015,19]nonadeca-1(17),2,4,6,9(18),10,12(19),15-octaen-13-ylidene)-14-thiapentacyclo[10.5.2.02,7.09,18.015,19]nonadeca-1(17),2,4,6,9(18),10,12(19),15-octaen-8-one
Also Known As: C.I.Vat Blue 7, C.I.70305, 5H,5'H-2,2'-bibenzo[4,5]phenaleno[1,9-bc]thiophene-5,5'-dione, (13Z)-13-(8-Oxo-14-thiapentacyclo[10.5.2.02,7.09,18.015,19]nonadeca-1(17),2,4,6,9(18),10,12(19),15-octaen-13-ylidene)-14-thiapentacyclo[10.5.2.02,7.09,18.015,19]nonadeca-1(17),2,4,6,9(18),10,12(19),15-octaen-8-one, delta2,2 (5H,5 H)-Bi[benzo[4,5]phenaleno[1,9-bc]thiophene]-5,5 -dione
| Molecular Formula | C36H16O2S2 |
|---|---|
| Molecular Weight | 544.06 g/mol |
| LogP | 9.56998 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 544.05914 |
| Heavy Atoms | 40 |
| Complexity | 2400.9897 |
Chemical Identifiers
| CAS Number | 5637-01-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=CC=C4C5=C(C=CC(=C35)C2=O)/C(=C/6\C7=C8C(=CC=C9C8=C(C=C7)C(=O)C1=CC=CC=C19)S6)/S4 |
Product Overview
C.I.Vat Blue 7 (CAS 5637-01-4), with molecular formula C36H16O2S2 and molecular weight 544.06 g/mol. IUPAC: (13Z)-13-(8-oxo-14-thiapentacyclo[10.5.2.02,7.09,18.015,19]nonadeca-1(17),2,4,6,9(18),10,12(19),15-octaen-13-ylidene)-14-thiapentacyclo[10.5.2.02,7.09,18.015,19]nonadeca-1(17),2,4,6,9(18),10,12(19),15-octaen-8-one.
Chemical Property Profile of C.I.Vat Blue 7
Property Insights of C.I.Vat Blue 7
The XLogP value of 9.56998 indicates that C.I.Vat Blue 7 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, C.I.Vat Blue 7 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C.I.Vat Blue 7 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C.I.Vat Blue 7?
The CAS number of C.I.Vat Blue 7 is 5637-01-4.
What is the molecular formula of C.I.Vat Blue 7?
The molecular formula of C.I.Vat Blue 7 is C36H16O2S2.
What is the molecular weight of C.I.Vat Blue 7?
The molecular weight of C.I.Vat Blue 7 is 544.06 g/mol.
Where can I buy C.I.Vat Blue 7?
You can request a quote for C.I.Vat Blue 7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C.I.Vat Blue 7?
Yes, KEHONG BIO provides custom synthesis services for C.I.Vat Blue 7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.