| CAS Number | 855991-57-0 |
| Catalog Number | AG00IDPT(AGN-PC-0WQYDY) |
| Chemical Name | 5-bromo-N-hydroxythiophene-2-carboxamide |
| IUPAC Name | 5-bromo-N-hydroxythiophene-2-carboxamide |
| InChI | InChI=1S/C5H4BrNO2S/c6-4-2-1-3(10-4)5(8)7-9/h1-2,9H,(H,7,8) |
| InChI Key | DUAVGTBNUROKDD-UHFFFAOYSA-N |
| MDL Number | MFCD06655927 |
| Molecular Formula | C5H4BrNO2S |
| Molecular Weight | 222.0598 |
| SMILES | ONC(C1SC(Br)=CC=1)=O |
| Synonyms | 5-bromo-N-hydroxythiophene-2-carboxamide,
855991-57-0,
AC1NLQQS,
AC1Q7DIH,
CTK8A6790,
HMS1783J12,
ZINC3888597,
MFCD06655927,
AKOS008969171,
MCULE-6517805850,
NE39558,
EN300-13558,
SR-01000070196,
SR-01000070196-1,
Z59182851,
ZINC03888597,
CID4962509,
|
| Complexity | 144 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.915g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.056g/mol |
| Monoisotopic Mass | 220.915g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 77.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number