| CAS Number | 1251922-57-2 |
| Catalog Number | AG01A9WU(AGN-PC-0WOUP9) |
| Chemical Name | methyl N-(cyanomethyl)-N-cyclopropylcarbamate |
| IUPAC Name | methyl N-(cyanomethyl)-N-cyclopropylcarbamate |
| InChI | InChI=1S/C7H10N2O2/c1-11-7(10)9(5-4-8)6-2-3-6/h6H,2-3,5H2,1H3 |
| InChI Key | CTZBHUSJQJFDTJ-UHFFFAOYSA-N |
| MDL Number | MFCD16817477 |
| Molecular Formula | C7H10N2O2 |
| Molecular Weight | 154.1665 |
| SMILES | COC(N(C1CC1)CC#N)=O |
| Synonyms | methyl N-(cyanomethyl)-N-cyclopropylcarbamate,
1251922-57-2,
AC1Q44BR,
ZINC57218497,
AKOS026743970,
MCULE-3040564977,
NE17401,
EN300-66398,
Z908238130,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.169g/mol |
| Monoisotopic Mass | 154.074g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 53.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number