| CAS Number | 115581-09-4 |
| Catalog Number | AG000G7H(AGN-PC-0K2EBD) |
| Chemical Name | 6-Quinolinol, 5-bromo- |
| IUPAC Name | 5-bromoquinolin-6-ol |
| InChI | InChI=1S/C9H6BrNO/c10-9-6-2-1-5-11-7(6)3-4-8(9)12/h1-5,12H |
| InChI Key | HQEFDTSINGDBKQ-UHFFFAOYSA-N |
| MDL Number | MFCD01463243 |
| Molecular Formula | C9H6BrNO |
| Molecular Weight | 224.0540 |
| SMILES | OC1=CC=C2N=CC=CC2=C1Br |
| Synonyms | 5-bromoquinolin-6-ol,
115581-09-4,
6-Quinolinol, 5-bromo-,
5-Bromo-6-hydroxyquinoline,
5-Bromo-6-quinolinol,
AC1LOBCQ,
5-Bromo-quinolin-6-ol,
SCHEMBL8745778,
DTXSID10361250,
ZINC1020147,
MFCD01463243,
AKOS015899848,
ACN-025158,
FCH1332699,
AJ-24689,
AS-43997,
AX8277557,
DB-060739,
FT-0706303,
I14-11910,
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| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.963g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.057g/mol |
| Monoisotopic Mass | 222.963g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 33.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number