2-甲氧基苯甲腈
TL;DR: 2-甲氧基苯甲腈 (CAS 6406-32-2) is a chemical compound with molecular formula C33H23N5Na2O6S2 and molecular weight 695.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-甲氧基苯甲腈
disodium;8-(4-methylanilino)-5-[(4-phenyldiazenyl-7-sulfonatonaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate
Also Known As: 2-Methoxybenzonitrile, Coomassie navy blue G, COOMASSIENAVYBLUEG, C.I. Acid Blue 118, disodium salt, Disodium 8-((4-methylphenyl)amino)-5-((4-(phenylazo)-7-sulphonatonaphthyl)azo)naphthalenesulphonate
| Molecular Formula | C33H23N5Na2O6S2 |
|---|---|
| Molecular Weight | 695.09 g/mol |
| LogP | 2.69 |
| Topological Polar Surface Area | 193.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 695.0885 |
| Heavy Atoms | 48 |
| Complexity | 1260.0 |
Chemical Identifiers
| CAS Number | 6406-32-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=C5C=C(C=CC5=C(C=C4)N=NC6=CC=CC=C6)S(=O)(=O)[O-])C=CC=C3S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | WIJFNHCSNFYEFH-UHFFFAOYSA-L |
Product Overview
2-甲氧基苯甲腈 (CAS 6406-32-2), with molecular formula C33H23N5Na2O6S2 and molecular weight 695.09 g/mol. IUPAC: disodium;8-(4-methylanilino)-5-[(4-phenyldiazenyl-7-sulfonatonaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate.
Chemical Property Profile of 2-甲氧基苯甲腈
Property Insights of 2-甲氧基苯甲腈
The XLogP value of 2.69 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-甲氧基苯甲腈. The TPSA of 193.0 Ų indicates high polarity, suggesting 2-甲氧基苯甲腈 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-甲氧基苯甲腈 has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-甲氧基苯甲腈?
The CAS number of 2-甲氧基苯甲腈 is 6406-32-2.
What is the molecular formula of 2-甲氧基苯甲腈?
The molecular formula of 2-甲氧基苯甲腈 is C33H23N5Na2O6S2.
What is the molecular weight of 2-甲氧基苯甲腈?
The molecular weight of 2-甲氧基苯甲腈 is 695.09 g/mol.
Where can I buy 2-甲氧基苯甲腈?
You can request a quote for 2-甲氧基苯甲腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-甲氧基苯甲腈?
Yes, KEHONG BIO provides custom synthesis services for 2-甲氧基苯甲腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.