Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester
TL;DR: Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester (CAS 56456-66-7) is a chemical compound with molecular formula C53H70CoN7O12 and molecular weight 1055.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cobalt(3+);methyl 3-[(5Z,10Z,15Z)-17-(2-cyanoethyl)-2,7,18-tris(2-methoxy-2-oxoethyl)-3,13-bis(3-methoxy-3-oxopropyl)-1,2,5,7,12,12,15,17-octamethyl-8,13,18,19-tetrahydro-3H-corrin-24-id-8-yl]propanoate;dicyanide
Also Known As: Cobyrinic acid hexamethyl ester f-nitrile, Cid 6443560, Cobyrinic acid-f-nitrile, dicyanide, hexamethyl ester, cobalt(3+);methyl 3-[(5Z,10Z,15Z)-17-(2-cyanoethyl)-2,7,18-tris(2-methoxy-2-oxoethyl)-3,13-bis(3-methoxy-3-oxopropyl)-1,2,5,7,12,12,15,17-octamethyl-8,13,18,19-tetrahydro-3H-corrin-24-id-8-yl]propanoate;dicyanide, Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester
| Molecular Formula | C53H70CoN7O12 |
|---|---|
| Molecular Weight | 1055.44 g/mol |
| LogP | 7.86312 |
| Topological Polar Surface Area | 280.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 17 |
| Exact Mass | 1055.4414 |
| Heavy Atoms | 73 |
| Complexity | 2423.4731 |
Chemical Identifiers
| CAS Number | 56456-66-7 |
|---|---|
| SMILES | C/C/1=C/2\C(C(C([N-]2)C3(C(C(C(=N3)/C(=C\4/C(C(C(=N4)/C=C\5/C(C(C1=N5)CCC(=O)OC)(C)C)CCC(=O)OC)(C)CC(=O)OC)/C)CCC(=O)OC)(C)CC(=O)OC)C)CC(=O)OC)(C)CCC#N.[C-]#N.[C-]#N.[Co+3] |
Product Overview
Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester (CAS 56456-66-7), with molecular formula C53H70CoN7O12 and molecular weight 1055.44 g/mol. IUPAC: cobalt(3+);methyl 3-[(5Z,10Z,15Z)-17-(2-cyanoethyl)-2,7,18-tris(2-methoxy-2-oxoethyl)-3,13-bis(3-methoxy-3-oxopropyl)-1,2,5,7,12,12,15,17-octamethyl-8,13,18,19-tetrahydro-3H-corrin-24-id-8-yl]propanoate;dicyanide.
Chemical Property Profile of Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester
Property Insights of Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester
The XLogP value of 7.86312 indicates that Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 280.35 Ų indicates high polarity, suggesting Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester has 0 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester?
The CAS number of Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester is 56456-66-7.
What is the molecular formula of Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester?
The molecular formula of Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester is C53H70CoN7O12.
What is the molecular weight of Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester?
The molecular weight of Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester is 1055.44 g/mol.
Where can I buy Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester?
You can request a quote for Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cobyrinic acid-f-nitrile, Co,Co-bis(cyano-kappaC)-, hexamethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.