| CAS Number | 426813-87-8 |
| Catalog Number | AG00D7TS |
| Chemical Name | N-Methyl-N-(propan-2-yl)carbamoyl chloride |
| IUPAC Name | N-methyl-N-propan-2-ylcarbamoyl chloride |
| InChI | InChI=1S/C5H10ClNO/c1-4(2)7(3)5(6)8/h4H,1-3H3 |
| InChI Key | VMLZTGZTAWBKSP-UHFFFAOYSA-N |
| MDL Number | MFCD23790122 |
| Molecular Formula | C5H10ClNO |
| Molecular Weight | 135.5920 |
| SMILES | CC(N(C(Cl)=O)C)C |
| Synonyms | 426813-87-8,
N-methyl-N-(propan-2-yl)carbamoyl chloride,
methyl(1-methylethyl)carbamic chloride,
n-methyl-n-isopropylcarbamoyl chloride,
SCHEMBL2894127,
VMLZTGZTAWBKSP-UHFFFAOYSA-N,
ZINC86889720,
AKOS018439913,
NE19033,
|
| Complexity | 92.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 135.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 135.591g/mol |
| Monoisotopic Mass | 135.045g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number