| CAS Number | 861339-27-7 |
| Catalog Number | AG01A3UV(AGN-PC-0WO0G7) |
| Chemical Name | 1-(Carbamoylamino)cyclopropane-1-carboxylic acid |
| IUPAC Name | 1-(carbamoylamino)cyclopropane-1-carboxylic acid |
| InChI | InChI=1S/C5H8N2O3/c6-4(10)7-5(1-2-5)3(8)9/h1-2H2,(H,8,9)(H3,6,7,10) |
| InChI Key | VECVSZDWIINWIK-UHFFFAOYSA-N |
| MDL Number | MFCD19210522 |
| Molecular Formula | C5H8N2O3 |
| Molecular Weight | 144.1286 |
| SMILES | NC(NC1(C(O)=O)CC1)=O |
| Synonyms | 1-(carbamoylamino)cyclopropane-1-carboxylic acid,
861339-27-7,
ZINC88613707,
AKOS006363336,
MCULE-5553928485,
NE26141,
Z1820178700,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.13g/mol |
| Monoisotopic Mass | 144.053g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 92.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number