Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine
TL;DR: Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine (CAS 73747-67-8) is a chemical compound with molecular formula C15H16IN3O3 and molecular weight 413.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]propanedinitrile;morpholine
Also Known As: Morpholinium 4-dicyanovinyl-2-iodo-6-methoxyphenoxide, MALONONITRILE, 2-(4-HYDROXY-3-IODO-5-METHOXYBENZYLIDENE)- compd. with MORPHOLINE, Propanedinitrile, compd. with morpholine (1:1), Propanedinitrile, ((4-hydroxy-3-iodo-5-methoxyphenyl)methylene)-, compd. with morpholine (1:1), 2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]propanedini
| Molecular Formula | C15H16IN3O3 |
|---|---|
| Molecular Weight | 413.02 g/mol |
| LogP | 2.04 |
| Topological Polar Surface Area | 98.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 413.02365 |
| Heavy Atoms | 22 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 73747-67-8 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)C=C(C#N)C#N)I)O.C1COCCN1 |
| InChIKey | BVXZJCJRUDJHCN-UHFFFAOYSA-N |
Product Overview
Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine (CAS 73747-67-8), with molecular formula C15H16IN3O3 and molecular weight 413.02 g/mol. IUPAC: 2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]propanedinitrile;morpholine.
Chemical Property Profile of Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine
Property Insights of Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine
The XLogP value of 2.04 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine. The TPSA of 98.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine. Following Lipinski's Rule of Five, Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine has 2 hydrogen bond donor(s) and 6 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 Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine?
The CAS number of Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine is 73747-67-8.
What is the molecular formula of Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine?
The molecular formula of Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine is C15H16IN3O3.
What is the molecular weight of Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine?
The molecular weight of Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine is 413.02 g/mol.
Where can I buy Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine?
You can request a quote for Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine?
Yes, KEHONG BIO provides custom synthesis services for Malononitrile, 2-(4-hydroxy-3-iodo-5-methoxybenzylidene)-compd. with morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.