| CAS Number | 10230-46-3 |
| Catalog Number | AG01C2EK(AGN-PC-0A4X6H) |
| Chemical Name | methyl N-(2-chloroethyl)-N-methylcarbamate |
| IUPAC Name | methyl N-(2-chloroethyl)-N-methylcarbamate |
| InChI | InChI=1S/C5H10ClNO2/c1-7(4-3-6)5(8)9-2/h3-4H2,1-2H3 |
| InChI Key | RASAJAJIGMQFBL-UHFFFAOYSA-N |
| MDL Number | MFCD19234949 |
| Molecular Formula | C5H10ClNO2 |
| Molecular Weight | 151.5914 |
| SMILES | COC(N(CCCl)C)=O |
| Synonyms | methyl N-(2-chloroethyl)-N-methylcarbamate,
10230-46-3,
SCHEMBL10828045,
AKOS006384635,
ZINC104724258,
|
| Complexity | 97 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 151.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.59g/mol |
| Monoisotopic Mass | 151.04g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number