4-吗啉丁腈
TL;DR: 4-吗啉丁腈 (CAS 59878-57-8) is a chemical compound with molecular formula C8H14N2O and molecular weight 154.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-吗啉丁腈
4-morpholin-4-ylbutanenitrile
Also Known As: 4-morpholinobutanenitrile, 4-Morpholinebutanenitrile, 4-morpholin-4-ylbutanenitrile, 4-morpholinobutyronitrile, 4-(morpholin-4-yl)butanenitrile
| Molecular Formula | C8H14N2O |
|---|---|
| Molecular Weight | 154.11 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.11061 |
| Heavy Atoms | 11 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 59878-57-8 |
|---|---|
| SMILES | C1COCCN1CCCC#N |
| InChIKey | DNHBZJPTXSALLZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-吗啉丁腈 (CAS 59878-57-8), with molecular formula C8H14N2O and molecular weight 154.11 g/mol. IUPAC: 4-morpholin-4-ylbutanenitrile.
Chemical Property Profile of 4-吗啉丁腈
Property Insights of 4-吗啉丁腈
The XLogP value of -0.1 indicates that 4-吗啉丁腈 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.3 Ų, 4-吗啉丁腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-吗啉丁腈 has 0 hydrogen bond donor(s) and 3 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 4-吗啉丁腈?
The CAS number of 4-吗啉丁腈 is 59878-57-8.
What is the molecular formula of 4-吗啉丁腈?
The molecular formula of 4-吗啉丁腈 is C8H14N2O.
What is the molecular weight of 4-吗啉丁腈?
The molecular weight of 4-吗啉丁腈 is 154.11 g/mol.
Where can I buy 4-吗啉丁腈?
You can request a quote for 4-吗啉丁腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-吗啉丁腈?
Yes, KEHONG BIO provides custom synthesis services for 4-吗啉丁腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.