Vitamin E Nicotinate
TL;DR: Vitamin E Nicotinate (CAS 51898-34-1) is a chemical compound with molecular formula C35H53NO3 and molecular weight 535.40 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] pyridine-3-carboxylate
Also Known As: Vitamin E Nicotinate, tocopherol nicotinate, Renascin, Hijuven, Juvela nicotinate
| Molecular Formula | C35H53NO3 |
|---|---|
| Molecular Weight | 535.40 g/mol |
| LogP | 11.4 |
| Topological Polar Surface Area | 48.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 535.4025 |
| Heavy Atoms | 39 |
| Complexity | 725.0 |
Chemical Identifiers
| CAS Number | 51898-34-1 |
|---|---|
| SMILES | CC1=C(C(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)OC(=O)C3=CN=CC=C3)C |
| InChIKey | MSCCTZZBYHQMQJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Vitamin E Nicotinate (CAS 51898-34-1), with molecular formula C35H53NO3 and molecular weight 535.40 g/mol. IUPAC: [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] pyridine-3-carboxylate.
Chemical Property Profile of Vitamin E Nicotinate
Property Insights of Vitamin E Nicotinate
The XLogP value of 11.4 indicates that Vitamin E Nicotinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.4 Ų, Vitamin E Nicotinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vitamin E Nicotinate 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 Vitamin E Nicotinate?
The CAS number of Vitamin E Nicotinate is 51898-34-1.
What is the molecular formula of Vitamin E Nicotinate?
The molecular formula of Vitamin E Nicotinate is C35H53NO3.
What is the molecular weight of Vitamin E Nicotinate?
The molecular weight of Vitamin E Nicotinate is 535.40 g/mol.
Where can I buy Vitamin E Nicotinate?
You can request a quote for Vitamin E Nicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vitamin E Nicotinate?
Yes, KEHONG BIO provides custom synthesis services for Vitamin E Nicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.