| CAS Number | 41643-82-7 |
| Catalog Number | AG00CJZX(AGN-PC-0WB5QR) |
| Chemical Name | 2-bromo-N-isopropylbutanamide |
| IUPAC Name | 2-bromo-N-propan-2-ylbutanamide |
| InChI | InChI=1S/C7H14BrNO/c1-4-6(8)7(10)9-5(2)3/h5-6H,4H2,1-3H3,(H,9,10) |
| InChI Key | XWTJTUDIWUHGOF-UHFFFAOYSA-N |
| MDL Number | MFCD12027349 |
| Molecular Formula | C7H14BrNO |
| Molecular Weight | 208.0962 |
| SMILES | C(C(CC)Br)(=O)NC(C)C |
| Synonyms | 2-bromo-N-isopropylbutanamide,
41643-82-7,
2-bromo-N-(propan-2-yl)butanamide,
C7H14BrNO,
CTK6C7117,
DTXSID30649289,
ALBB-007264,
2965AE,
MFCD12027349,
STK504412,
AKOS000264978,
AKOS016345539,
TR-059622,
Y-6986,
2-bromo-N-propan-2-ylbutanamide,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.099g/mol |
| Monoisotopic Mass | 207.026g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number