2-Chromen-2-ylidenepropanedinitrile
TL;DR: 2-Chromen-2-ylidenepropanedinitrile (CAS 64915-00-0) is a chemical compound with molecular formula C12H6N2O and molecular weight 194.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chromen-2-ylidenepropanedinitrile
Also Known As: 2-chromen-2-ylidenepropanedinitrile, 2-coumarylidenemalononitrile, 2h-chromen-2-ylidenepropanedinitrile, 2-dicyanomethylene-2h-1-benzopyran, 2-(2H-chromen-2-ylidene)propanedinitrile
| Molecular Formula | C12H6N2O |
|---|---|
| Molecular Weight | 194.05 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.04802 |
| Heavy Atoms | 15 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 64915-00-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C(C#N)C#N)O2 |
| InChIKey | DGOGRNQPIVBVLB-UHFFFAOYSA-N |
Product Overview
2-Chromen-2-ylidenepropanedinitrile (CAS 64915-00-0), with molecular formula C12H6N2O and molecular weight 194.05 g/mol. IUPAC: 2-chromen-2-ylidenepropanedinitrile.
Chemical Property Profile of 2-Chromen-2-ylidenepropanedinitrile
Property Insights of 2-Chromen-2-ylidenepropanedinitrile
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chromen-2-ylidenepropanedinitrile. With a topological polar surface area (TPSA) of 56.8 Ų, 2-Chromen-2-ylidenepropanedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chromen-2-ylidenepropanedinitrile has 0 hydrogen bond donor(s) and 3 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-Chromen-2-ylidenepropanedinitrile?
The CAS number of 2-Chromen-2-ylidenepropanedinitrile is 64915-00-0.
What is the molecular formula of 2-Chromen-2-ylidenepropanedinitrile?
The molecular formula of 2-Chromen-2-ylidenepropanedinitrile is C12H6N2O.
What is the molecular weight of 2-Chromen-2-ylidenepropanedinitrile?
The molecular weight of 2-Chromen-2-ylidenepropanedinitrile is 194.05 g/mol.
Where can I buy 2-Chromen-2-ylidenepropanedinitrile?
You can request a quote for 2-Chromen-2-ylidenepropanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chromen-2-ylidenepropanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Chromen-2-ylidenepropanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.