2-(Diaminomethylidene)propanedinitrile
TL;DR: 2-(Diaminomethylidene)propanedinitrile (CAS 1187-12-8) is a chemical compound with molecular formula C4H4N4 and molecular weight 108.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diaminomethylidene)propanedinitrile
Also Known As: 2-(diaminomethylidene)propanedinitrile, Propanedinitrile, (diaminomethylene)-, diamino methylidenemalononitrile, 2-(Diaminomethylene)malononitrile, 1,1-diamino-2,2-dicyanoethylene
| Molecular Formula | C4H4N4 |
|---|---|
| Molecular Weight | 108.04 g/mol |
| LogP | -0.83744 |
| Topological Polar Surface Area | 99.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 108.043594 |
| Heavy Atoms | 8 |
| Complexity | 169.0643 |
Chemical Identifiers
| CAS Number | 1187-12-8 |
|---|---|
| SMILES | C(#N)C(=C(N)N)C#N |
Product Overview
2-(Diaminomethylidene)propanedinitrile (CAS 1187-12-8), with molecular formula C4H4N4 and molecular weight 108.04 g/mol. IUPAC: 2-(diaminomethylidene)propanedinitrile.
Chemical Property Profile of 2-(Diaminomethylidene)propanedinitrile
Property Insights of 2-(Diaminomethylidene)propanedinitrile
The XLogP value of -0.83744 indicates that 2-(Diaminomethylidene)propanedinitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Diaminomethylidene)propanedinitrile. Following Lipinski's Rule of Five, 2-(Diaminomethylidene)propanedinitrile has 2 hydrogen bond donor(s) and 4 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-(Diaminomethylidene)propanedinitrile?
The CAS number of 2-(Diaminomethylidene)propanedinitrile is 1187-12-8.
What is the molecular formula of 2-(Diaminomethylidene)propanedinitrile?
The molecular formula of 2-(Diaminomethylidene)propanedinitrile is C4H4N4.
What is the molecular weight of 2-(Diaminomethylidene)propanedinitrile?
The molecular weight of 2-(Diaminomethylidene)propanedinitrile is 108.04 g/mol.
Where can I buy 2-(Diaminomethylidene)propanedinitrile?
You can request a quote for 2-(Diaminomethylidene)propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diaminomethylidene)propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diaminomethylidene)propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.