3-Tritriacontanone
TL;DR: 3-Tritriacontanone (CAS 79097-23-7) is a chemical compound with molecular formula C33H66O and molecular weight 478.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tritriacontan-3-one
Also Known As: 3-Tritriacontanone, Tritriacontan-3-one, 3-Tritriacontanone #, RefChem:95501
| Molecular Formula | C33H66O |
|---|---|
| Molecular Weight | 478.51 g/mol |
| LogP | 15.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 30 |
| Exact Mass | 478.51135 |
| Heavy Atoms | 34 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 79097-23-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)CC |
| InChIKey | AJSCLJOGICXEJM-UHFFFAOYSA-N |
Product Overview
3-Tritriacontanone (CAS 79097-23-7), with molecular formula C33H66O and molecular weight 478.51 g/mol. IUPAC: tritriacontan-3-one.
Chemical Property Profile of 3-Tritriacontanone
Property Insights of 3-Tritriacontanone
The XLogP value of 15.9 indicates that 3-Tritriacontanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3-Tritriacontanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Tritriacontanone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Tritriacontanone?
The CAS number of 3-Tritriacontanone is 79097-23-7.
What is the molecular formula of 3-Tritriacontanone?
The molecular formula of 3-Tritriacontanone is C33H66O.
What is the molecular weight of 3-Tritriacontanone?
The molecular weight of 3-Tritriacontanone is 478.51 g/mol.
Where can I buy 3-Tritriacontanone?
You can request a quote for 3-Tritriacontanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Tritriacontanone?
Yes, KEHONG BIO provides custom synthesis services for 3-Tritriacontanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.