RefChem:1060006
TL;DR: RefChem:1060006 (CAS 85446-83-9) is a chemical compound with molecular formula C41H56ClNO4 and molecular weight 661.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] 5-(4-chlorophenoxy)pyridine-2-carboxylate
Also Known As: dl-alpha-Tocopheryl 5-(4-chlorophenyloxy)picolinate, 2-Pyridinecarboxylic acid, 5-(4-chlorophenoxy)-, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl ester, 2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-yl 5-(4-chlorophenoxy)pyridine-2-carboxylate, [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] 5-(4-chlorophenoxy)pyridine-2-carboxylate, RefChem:1060006
| Molecular Formula | C41H56ClNO4 |
|---|---|
| Molecular Weight | 661.39 g/mol |
| LogP | 12.19456 |
| Topological Polar Surface Area | 57.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 16 |
| Exact Mass | 661.3898 |
| Heavy Atoms | 47 |
| Complexity | 1466.5 |
Chemical Identifiers
| CAS Number | 85446-83-9 |
|---|---|
| SMILES | CC1=C(C(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)OC(=O)C3=NC=C(C=C3)OC4=CC=C(C=C4)Cl)C |
Product Overview
RefChem:1060006 (CAS 85446-83-9), with molecular formula C41H56ClNO4 and molecular weight 661.39 g/mol. IUPAC: [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] 5-(4-chlorophenoxy)pyridine-2-carboxylate.
Chemical Property Profile of RefChem:1060006
Property Insights of RefChem:1060006
The XLogP value of 12.19456 indicates that RefChem:1060006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.65 Ų, RefChem:1060006 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1060006 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1060006?
The CAS number of RefChem:1060006 is 85446-83-9.
What is the molecular formula of RefChem:1060006?
The molecular formula of RefChem:1060006 is C41H56ClNO4.
What is the molecular weight of RefChem:1060006?
The molecular weight of RefChem:1060006 is 661.39 g/mol.
Where can I buy RefChem:1060006?
You can request a quote for RefChem:1060006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1060006?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1060006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.