| CAS Number | 67029-82-7 |
| Catalog Number | AG006MUL(AGN-PC-07Y025) |
| Chemical Name | Ethanone, 2-bromo-1-(1-hydroxy-2-naphthalenyl)- |
| IUPAC Name | 2-bromo-1-(1-hydroxynaphthalen-2-yl)ethanone |
| InChI | InChI=1S/C12H9BrO2/c13-7-11(14)10-6-5-8-3-1-2-4-9(8)12(10)15/h1-6,15H,7H2 |
| InChI Key | ADLPBUIQLXKAAC-UHFFFAOYSA-N |
| MDL Number | MFCD09745923 |
| Molecular Formula | C12H9BrO2 |
| Molecular Weight | 265.1027 |
| SMILES | BrCC(C1=CC=C2C=CC=CC2=C1O)=O |
| Synonyms | 2-BROMO-1-(1-HYDROXYNAPHTHALEN-2-YL)ETHANONE,
67029-82-7,
2-bromo-1-(1-hydroxynaphthalen-2-yl)ethan-1-one,
CTK1J3987,
DTXSID50673743,
ANW-45394,
ZINC37638496,
AKOS015919592,
AJ-94206,
AK-68329,
BR-68329,
AX8218259,
TC-134139,
CS-0060582,
ST24022021,
W7768,
2-bromo-1-(1-hydroxy-2-naphthalenyl)Ethanone,
Ethanone, 2-bromo-1-(1-hydroxy-2-naphthalenyl)-,
C12H9BrO2,
S-7320,
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| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.106g/mol |
| Monoisotopic Mass | 263.979g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number