N-Heptafluorobutyrylmorpholine
TL;DR: N-Heptafluorobutyrylmorpholine (CAS 425-20-7) is a chemical compound with molecular formula C8H8F7NO2 and molecular weight 283.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,3,4,4,4-heptafluoro-1-morpholin-4-ylbutan-1-one
Also Known As: N-Heptafluorobutyrylmorpholine, 2,2,3,3,4,4,4-Heptafluoro-1-(morpholin-4-yl)butan-1-one, J1.477.954J, 1-Morpholino-2,2,3,3,4,4,4-heptafluoro-1-butanone, 4-(2,2,3,3,4,4,4-Heptafluorobutanoyl)morpholine #
| Molecular Formula | C8H8F7NO2 |
|---|---|
| Molecular Weight | 283.04 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.0443 |
| Heavy Atoms | 18 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 425-20-7 |
|---|---|
| SMILES | C1COCCN1C(=O)C(C(C(F)(F)F)(F)F)(F)F |
| InChIKey | MKGSIZTXMDXSMT-UHFFFAOYSA-N |
Product Overview
N-Heptafluorobutyrylmorpholine (CAS 425-20-7), with molecular formula C8H8F7NO2 and molecular weight 283.04 g/mol. IUPAC: 2,2,3,3,4,4,4-heptafluoro-1-morpholin-4-ylbutan-1-one.
Chemical Property Profile of N-Heptafluorobutyrylmorpholine
Property Insights of N-Heptafluorobutyrylmorpholine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Heptafluorobutyrylmorpholine. With a topological polar surface area (TPSA) of 29.5 Ų, N-Heptafluorobutyrylmorpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Heptafluorobutyrylmorpholine has 0 hydrogen bond donor(s) and 9 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 N-Heptafluorobutyrylmorpholine?
The CAS number of N-Heptafluorobutyrylmorpholine is 425-20-7.
What is the molecular formula of N-Heptafluorobutyrylmorpholine?
The molecular formula of N-Heptafluorobutyrylmorpholine is C8H8F7NO2.
What is the molecular weight of N-Heptafluorobutyrylmorpholine?
The molecular weight of N-Heptafluorobutyrylmorpholine is 283.04 g/mol.
Where can I buy N-Heptafluorobutyrylmorpholine?
You can request a quote for N-Heptafluorobutyrylmorpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Heptafluorobutyrylmorpholine?
Yes, KEHONG BIO provides custom synthesis services for N-Heptafluorobutyrylmorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.