3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one
TL;DR: 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one (CAS 154301-46-9) is a chemical compound with molecular formula C12H21F3OS2 and molecular weight 302.0986 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1,1-trifluoro-3-(9-sulfanylnonylsulfanyl)propan-2-one
Also Known As: MNTFP, 1,1,1-trifluoro-3-(9-sulfanylnonylsulfanyl)propan-2-one, 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one, 3-(9'-Mercaptononylthio)-1,1,1-trifluoropropan-2-one, 3-(9/'-mercaptononylthio)-1,1,1,-trifluoropropan-2-one
Technical Specifications
| Molecular Formula | C12H21F3OS2 |
| Molecular Weight | 302.0986 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 302.0986 Da |
| Heavy Atoms | 18 |
| Complexity | 220.0 |
| SMILES | C(CCCCS)CCCCSCC(=O)C(F)(F)F |
| InChIKey | VGYNCMOKRPXEGF-UHFFFAOYSA-N |
Chemical Property Profile of 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one
Property Insights of 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one
The XLogP value of 5.1 indicates that 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one?
The CAS number of 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one is 154301-46-9.
What is the molecular formula of 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one?
The molecular formula of 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one is C12H21F3OS2.
What is the molecular weight of 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one?
The molecular weight of 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one is 302.0986 g/mol.
Where can I buy 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one?
You can request a quote for 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one?
Yes, CoreyChem provides custom synthesis services for 3-(9'-Mercaptononylthio)-1,1,1,-trifluoropropan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.