2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile
TL;DR: 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile (CAS 339103-06-9) is a chemical compound with molecular formula C15H15FN4O and molecular weight 286.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(dimethylamino)-3-[(2-fluorophenyl)methoxyimino]propylidene]propanedinitrile
Also Known As: 2-(1-(dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile, 2-[1-(dimethylamino)-3-[(2-fluorophenyl)methoxyimino]propylidene]propanedinitrile, 2-[1-dimethylamino-3-[(2-fluorophenyl)methoxyimino]propylidene]propanedinitrile
| Molecular Formula | C15H15FN4O |
|---|---|
| Molecular Weight | 286.12 g/mol |
| LogP | 2.58106 |
| Topological Polar Surface Area | 72.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 286.123 |
| Heavy Atoms | 21 |
| Complexity | 607.29614 |
Chemical Identifiers
| CAS Number | 339103-06-9 |
|---|---|
| SMILES | CN(C)C(=C(C#N)C#N)CC=NOCC1=CC=CC=C1F |
Product Overview
2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile (CAS 339103-06-9), with molecular formula C15H15FN4O and molecular weight 286.12 g/mol. IUPAC: 2-[1-(dimethylamino)-3-[(2-fluorophenyl)methoxyimino]propylidene]propanedinitrile.
Chemical Property Profile of 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile
Property Insights of 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile
The XLogP value of 2.58106 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile. The TPSA of 72.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile. Following Lipinski's Rule of Five, 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile 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 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile?
The CAS number of 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile is 339103-06-9.
What is the molecular formula of 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile?
The molecular formula of 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile is C15H15FN4O.
What is the molecular weight of 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile?
The molecular weight of 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile is 286.12 g/mol.
Where can I buy 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile?
You can request a quote for 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-(Dimethylamino)-3-{[(2-fluorobenzyl)oxy]imino}propylidene)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.