3-Hydroxytridecanenitrile
TL;DR: 3-Hydroxytridecanenitrile (CAS 30683-74-0) is a chemical compound with molecular formula C13H25NO and molecular weight 211.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxytridecanenitrile
Also Known As: 3-hydroxytridecanenitrile, 8-Hydroxytridecanenitrile, Tridecanenitrile,3-hydroxy-, 250-289-4, RefChem:94415
| Molecular Formula | C13H25NO |
|---|---|
| Molecular Weight | 211.19 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 44.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 211.19362 |
| Heavy Atoms | 15 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 30683-74-0 |
|---|---|
| SMILES | CCCCCCCCCCC(CC#N)O |
| InChIKey | BMSKXVOVAICYGJ-UHFFFAOYSA-N |
Product Overview
3-Hydroxytridecanenitrile (CAS 30683-74-0), with molecular formula C13H25NO and molecular weight 211.19 g/mol. IUPAC: 3-hydroxytridecanenitrile.
Chemical Property Profile of 3-Hydroxytridecanenitrile
Property Insights of 3-Hydroxytridecanenitrile
The XLogP value of 4.3 indicates that 3-Hydroxytridecanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.0 Ų, 3-Hydroxytridecanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxytridecanenitrile has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Hydroxytridecanenitrile?
The CAS number of 3-Hydroxytridecanenitrile is 30683-74-0.
What is the molecular formula of 3-Hydroxytridecanenitrile?
The molecular formula of 3-Hydroxytridecanenitrile is C13H25NO.
What is the molecular weight of 3-Hydroxytridecanenitrile?
The molecular weight of 3-Hydroxytridecanenitrile is 211.19 g/mol.
Where can I buy 3-Hydroxytridecanenitrile?
You can request a quote for 3-Hydroxytridecanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxytridecanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxytridecanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.