C.I. Vat Green 1
TL;DR: C.I. Vat Green 1 (CAS 128-58-5) is a chemical compound with molecular formula C36H20O4 and molecular weight 516.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
30,34-dimethoxynonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(30),2(34),3(16),4(13),5(33),6,8,10,14,17(31),18,20(32),22,24,26,28-hexadecaene-12,21-dione
Also Known As: Vat Green 1, CI VAT GREEN 1, Jade Green Base, Caledon Jade Green, Brilliant Green S
| Molecular Formula | C36H20O4 |
|---|---|
| Molecular Weight | 516.14 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 516.13617 |
| Heavy Atoms | 40 |
| Complexity | 971.0 |
Chemical Identifiers
| CAS Number | 128-58-5 |
|---|---|
| SMILES | COC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OC |
| InChIKey | JXUKQCUPTNLTCS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
C.I. Vat Green 1 (CAS 128-58-5), with molecular formula C36H20O4 and molecular weight 516.14 g/mol. IUPAC: 30,34-dimethoxynonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(30),2(34),3(16),4(13),5(33),6,8,10,14,17(31),18,20(32),22,24,26,28-hexadecaene-12,21-dione.
Chemical Property Profile of C.I. Vat Green 1
Property Insights of C.I. Vat Green 1
The XLogP value of 8.0 indicates that C.I. Vat Green 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, C.I. Vat Green 1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C.I. Vat Green 1 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 Green 1?
The CAS number of C.I. Vat Green 1 is 128-58-5.
What is the molecular formula of C.I. Vat Green 1?
The molecular formula of C.I. Vat Green 1 is C36H20O4.
What is the molecular weight of C.I. Vat Green 1?
The molecular weight of C.I. Vat Green 1 is 516.14 g/mol.
Where can I buy C.I. Vat Green 1?
You can request a quote for C.I. Vat Green 1 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 Green 1?
Yes, KEHONG BIO provides custom synthesis services for C.I. Vat Green 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.