| CAS Number | 2011-70-3 |
| Catalog Number | AG002D77(AGN-PC-07Y4SI) |
| Chemical Name | 5-Nitro-2-(bromoacetamido)benzophenone |
| EC Number | 217-932-0 |
| IUPAC Name | N-(2-benzoyl-4-nitrophenyl)-2-bromoacetamide |
| InChI | InChI=1S/C15H11BrN2O4/c16-9-14(19)17-13-7-6-11(18(21)22)8-12(13)15(20)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,19) |
| InChI Key | USZJZGVAIGKLRF-UHFFFAOYSA-N |
| MDL Number | MFCD16251476 |
| Molecular Formula | C15H11BrN2O4 |
| Molecular Weight | 363.1628 |
| SMILES | O=C(C1=CC([N+]([O-])=O)=CC=C1NC(CBr)=O)C2=CC=CC=C2 |
| Synonyms | N-(2-Benzoyl-4-nitrophenyl)-2-bromoacetamide,
2011-70-3,
Acetamide,N-(2-benzoyl-4-nitrophenyl)-2-bromo-,
W-109739,
EINECS 217-932-0,
AC1MHWX3,
CTK4E3322,
DTXSID80173928,
ZINC22064610,
AKOS027447558,
ACM2011703,
2'-Benzoyl-2-bromo-4'-nitroacetanilide,
FT-0672779,
5-NITRO-2-(BROMOACETAMIDO)BENZOPHENONE,
Acetamide, N-(2-benzoyl-4-nitrophenyl)-2-bromo-,
2-Bromo-N-[4-nitro-2-(phenyl-carbonyl)phenyl]acetamide,
C15H11BrN2O4,
C15-H11-Br-N2-O4,
CID3034124,
|
| Complexity | 432 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 361.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 363.167g/mol |
| Monoisotopic Mass | 361.99g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 92A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number