Propanedinitrile, ethylidene-
TL;DR: Propanedinitrile, ethylidene- (CAS 1508-07-2) is a chemical compound with molecular formula C5H4N2 and molecular weight 92.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylidenepropanedinitrile
Also Known As: 2-ethylidenepropanedinitrile, Propanedinitrile, ethylidene-, ethylidenemalononitrile, 1,1-dicyanopropene, 2-ethylidene malononitrile
| Molecular Formula | C5H4N2 |
|---|---|
| Molecular Weight | 92.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 92.037445 |
| Heavy Atoms | 7 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 1508-07-2 |
|---|---|
| SMILES | CC=C(C#N)C#N |
| InChIKey | VPGXPWHNPQONBA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propanedinitrile, ethylidene- (CAS 1508-07-2), with molecular formula C5H4N2 and molecular weight 92.04 g/mol. IUPAC: 2-ethylidenepropanedinitrile.
Chemical Property Profile of Propanedinitrile, ethylidene-
Property Insights of Propanedinitrile, ethylidene-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanedinitrile, ethylidene-. With a topological polar surface area (TPSA) of 47.6 Ų, Propanedinitrile, ethylidene- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanedinitrile, ethylidene- has 0 hydrogen bond donor(s) and 2 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 Propanedinitrile, ethylidene-?
The CAS number of Propanedinitrile, ethylidene- is 1508-07-2.
What is the molecular formula of Propanedinitrile, ethylidene-?
The molecular formula of Propanedinitrile, ethylidene- is C5H4N2.
What is the molecular weight of Propanedinitrile, ethylidene-?
The molecular weight of Propanedinitrile, ethylidene- is 92.04 g/mol.
Where can I buy Propanedinitrile, ethylidene-?
You can request a quote for Propanedinitrile, ethylidene- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanedinitrile, ethylidene-?
Yes, KEHONG BIO provides custom synthesis services for Propanedinitrile, ethylidene- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.