3,3'-三硫代双丙腈
TL;DR: 3,3'-三硫代双丙腈 (CAS 63815-40-7) is a chemical compound with molecular formula C6H8N2S3 and molecular weight 203.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3'-三硫代双丙腈
3-(2-cyanoethyltrisulfanyl)propanenitrile
Also Known As: Trithiodipropionitrile, Propionitrile, 3,3'-trithiodi-, bis (2-cyanoethyl) trisulfure, 3,3'-Trisulfanediyldipropanenitrile, Propanenitrile, 3,3'-trithiobis-
| Molecular Formula | C6H8N2S3 |
|---|---|
| Molecular Weight | 203.98 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 203.98495 |
| Heavy Atoms | 11 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 63815-40-7 |
|---|---|
| SMILES | C(CSSSCCC#N)C#N |
| InChIKey | QHYZLSAALVIFME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-三硫代双丙腈 (CAS 63815-40-7), with molecular formula C6H8N2S3 and molecular weight 203.98 g/mol. IUPAC: 3-(2-cyanoethyltrisulfanyl)propanenitrile.
Chemical Property Profile of 3,3'-三硫代双丙腈
Property Insights of 3,3'-三硫代双丙腈
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-三硫代双丙腈. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-三硫代双丙腈. Following Lipinski's Rule of Five, 3,3'-三硫代双丙腈 has 0 hydrogen bond donor(s) and 5 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 3,3'-三硫代双丙腈?
The CAS number of 3,3'-三硫代双丙腈 is 63815-40-7.
What is the molecular formula of 3,3'-三硫代双丙腈?
The molecular formula of 3,3'-三硫代双丙腈 is C6H8N2S3.
What is the molecular weight of 3,3'-三硫代双丙腈?
The molecular weight of 3,3'-三硫代双丙腈 is 203.98 g/mol.
Where can I buy 3,3'-三硫代双丙腈?
You can request a quote for 3,3'-三硫代双丙腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-三硫代双丙腈?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-三硫代双丙腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.