| CAS Number | 404965-07-7 |
| Catalog Number | AG00IWRI(AGN-PC-03OPNH) |
| Chemical Name | 1-Bromo-3-methoxynaphthalen-2-ol |
| IUPAC Name | 1-bromo-3-methoxynaphthalen-2-ol |
| InChI | InChI=1S/C11H9BrO2/c1-14-9-6-7-4-2-3-5-8(7)10(12)11(9)13/h2-6,13H,1H3 |
| InChI Key | WQTNUNHZFJXLNX-UHFFFAOYSA-N |
| MDL Number | MFCD20232913 |
| Molecular Formula | C11H9BrO2 |
| Molecular Weight | 253.0920 |
| SMILES | [Br]C1(=C(O)C(OC)=CC2(=C1C=CC=C2)) |
| Synonyms | 1-bromo-3-methoxynaphthalen-2-ol,
404965-07-7,
1-bromo-3-methoxy-naphthalen-2-ol,
bromomethoxynaphthalenol,
1-Bromo-3-methoxy-2-naphthol,
SCHEMBL6345611,
ZX-RL003284,
MFCD20232913,
ZINC71788962,
AKOS015991441,
FCH1416335,
GF-0721,
MCULE-5040710718,
RP14379,
KS-000025I8,
OR310029,
|
| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.095g/mol |
| Monoisotopic Mass | 251.979g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number