(Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate
TL;DR: (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate (CAS 4192-06-7) is a chemical compound with molecular formula C7H7F7N2O and molecular weight 268.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate
Also Known As: KST-1A0294, (1z)-2,2,3,3,4,4,4-heptafluoro-1-[(propan-2-ylideneamino)oxy]butan-1-imine, (propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate
| Molecular Formula | C7H7F7N2O |
|---|---|
| Molecular Weight | 268.04 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 45.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.04465 |
| Heavy Atoms | 17 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 4192-06-7 |
|---|---|
| SMILES | CC(=NOC(=N)C(C(C(F)(F)F)(F)F)(F)F)C |
| InChIKey | NMKKUIDEWHVRRV-UHFFFAOYSA-N |
Product Overview
(Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate (CAS 4192-06-7), with molecular formula C7H7F7N2O and molecular weight 268.04 g/mol. IUPAC: (propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate.
Chemical Property Profile of (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate
Property Insights of (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate. With a topological polar surface area (TPSA) of 45.4 Ų, (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate has 1 hydrogen bond donor(s) and 10 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 (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate?
The CAS number of (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate is 4192-06-7.
What is the molecular formula of (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate?
The molecular formula of (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate is C7H7F7N2O.
What is the molecular weight of (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate?
The molecular weight of (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate is 268.04 g/mol.
Where can I buy (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate?
You can request a quote for (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate?
Yes, KEHONG BIO provides custom synthesis services for (Propan-2-ylideneamino) 2,2,3,3,4,4,4-heptafluorobutanimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.