| CAS Number | 1250809-34-7 |
| Catalog Number | AG01AA1D(AGN-PC-0WOBHZ) |
| Chemical Name | 1-(methylcarbamoyl)cyclopropane-1-carboxylic acid |
| IUPAC Name | 1-(methylcarbamoyl)cyclopropane-1-carboxylic acid |
| InChI | InChI=1S/C6H9NO3/c1-7-4(8)6(2-3-6)5(9)10/h2-3H2,1H3,(H,7,8)(H,9,10) |
| InChI Key | ZHKJJVGESBQQBR-UHFFFAOYSA-N |
| MDL Number | MFCD16669521 |
| Molecular Formula | C6H9NO3 |
| Molecular Weight | 143.1406 |
| SMILES | CNC(C1(C(O)=O)CC1)=O |
| Synonyms | 1-(methylcarbamoyl)cyclopropane-1-carboxylic acid,
1250809-34-7,
1-(Methylcarbamoyl)cyclopropanecarboxylic acid,
AC1Q40J1,
ZINC50289641,
AKOS011374664,
MCULE-1909083856,
NE18980,
AJ-111574,
EN300-66770,
Z1259162177,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.058g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.142g/mol |
| Monoisotopic Mass | 143.058g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 66.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number