| CAS Number | 31136-78-4 |
| Catalog Number | AG00BESO(AGN-PC-0M0N61) |
| Chemical Name | 5-Bromo-N-methylfuran-2-carboxamide |
| IUPAC Name | 5-bromo-N-methylfuran-2-carboxamide |
| InChI | InChI=1S/C6H6BrNO2/c1-8-6(9)4-2-3-5(7)10-4/h2-3H,1H3,(H,8,9) |
| InChI Key | QMUCVHLODHSPLZ-UHFFFAOYSA-N |
| MDL Number | MFCD06093352 |
| Molecular Formula | C6H6BrNO2 |
| Molecular Weight | 204.0213 |
| SMILES | O=C(C1=CC=C(Br)O1)NC |
| Synonyms | 5-BROMO-N-METHYL-2-FURAMIDE,
5-bromo-N-methylfuran-2-carboxamide,
31136-78-4,
AC1ONGJL,
SCHEMBL12050744,
CTK4G6448,
DTXSID40428704,
CHEMBRDG-BB 7344619,
ZINC5171864,
MFCD06093352,
N-Methyl-5-bromofuran-2-carboxamide,
AKOS001379244,
MCULE-7832285133,
(5-bromo(2-furyl))-N-methylcarboxamide,
AJ-53459,
ST45009065,
Y-2064,
Z32016557,
F2124-0362,
ZINC05171864,
CID7535013,
|
| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.958g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.023g/mol |
| Monoisotopic Mass | 202.958g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number