| CAS Number | 49552-23-0 |
| Catalog Number | AG01A63P(AGN-PC-0OB01F) |
| Chemical Name | [(4-methylimidazolidin-2-ylidene)amino]formonitrile |
| IUPAC Name | (5-methyl-4,5-dihydro-1H-imidazol-2-yl)cyanamide |
| InChI | InChI=1S/C5H8N4/c1-4-2-7-5(9-4)8-3-6/h4H,2H2,1H3,(H2,7,8,9) |
| InChI Key | MWBFNHMAAAQSCT-UHFFFAOYSA-N |
| MDL Number | MFCD19221714 |
| Molecular Formula | C5H8N4 |
| Molecular Weight | 124.1438 |
| SMILES | CC1NC(=NC#N)NC1 |
| Synonyms | [(4-methylimidazolidin-2-ylidene)amino]carbonitrile,
49552-23-0,
AKOS006358910,
NE22182,
[(4-methylimidazolidin-2-ylidene)amino]formonitrile,
|
| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 124.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 124.147g/mol |
| Monoisotopic Mass | 124.075g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 60.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
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Certificate of Analysis
Lot Number