C.I.Mordant Violet 1
TL;DR: C.I.Mordant Violet 1 (CAS 7452-51-9) is a chemical compound with molecular formula C27H27NO6 and molecular weight 461.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-[4-(diethylamino)phenyl]methyl]-2-hydroxy-3-methylbenzoic acid
Also Known As: C.I.Mordant Violet 1, MORDANT VIOLET 1, C.I. Mordant Violet 1, 5-[(3-Carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-[4-(diethylamino)phenyl]methyl]-2-hydroxy-3-methylbenzoic acid, 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[4-(diethylamino)phenyl]methyl]-3-methylsalicylic acid
| Molecular Formula | C27H27NO6 |
|---|---|
| Molecular Weight | 461.18 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.18384 |
| Heavy Atoms | 34 |
| Complexity | 904.0 |
Chemical Identifiers
| CAS Number | 7452-51-9 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C(=C2C=C(C(=O)C(=C2)C(=O)O)C)C3=CC(=C(C(=C3)C)O)C(=O)O |
| InChIKey | MHXLUBGHVIPIGK-UHFFFAOYSA-N |
Product Overview
C.I.Mordant Violet 1 (CAS 7452-51-9), with molecular formula C27H27NO6 and molecular weight 461.18 g/mol. IUPAC: 5-[(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-[4-(diethylamino)phenyl]methyl]-2-hydroxy-3-methylbenzoic acid.
Chemical Property Profile of C.I.Mordant Violet 1
Property Insights of C.I.Mordant Violet 1
The XLogP value of 6.2 indicates that C.I.Mordant Violet 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C.I.Mordant Violet 1. Following Lipinski's Rule of Five, C.I.Mordant Violet 1 has 3 hydrogen bond donor(s) and 7 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.Mordant Violet 1?
The CAS number of C.I.Mordant Violet 1 is 7452-51-9.
What is the molecular formula of C.I.Mordant Violet 1?
The molecular formula of C.I.Mordant Violet 1 is C27H27NO6.
What is the molecular weight of C.I.Mordant Violet 1?
The molecular weight of C.I.Mordant Violet 1 is 461.18 g/mol.
Where can I buy C.I.Mordant Violet 1?
You can request a quote for C.I.Mordant Violet 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.Mordant Violet 1?
Yes, KEHONG BIO provides custom synthesis services for C.I.Mordant Violet 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.