| CAS Number | 514844-65-6 |
| Catalog Number | AG019F0L(AGN-PC-0OBIJT) |
| Chemical Name | 4-Bromo-1-Methoxy-2-Naphthalenecarboxaldehyde |
| IUPAC Name | 4-bromo-1-methoxynaphthalene-2-carbaldehyde |
| InChI | InChI=1S/C12H9BrO2/c1-15-12-8(7-14)6-11(13)9-4-2-3-5-10(9)12/h2-7H,1H3 |
| InChI Key | ZNGLQDHNUMVTFL-UHFFFAOYSA-N |
| MDL Number | MFCD31652794 |
| Molecular Formula | C12H9BrO2 |
| Molecular Weight | 265.1027 |
| SMILES | COc1c(C=O)cc(c2c1cccc2)Br |
| Synonyms | 4-Bromo-1-methoxynaphthalene-2-carbaldehyde,
514844-65-6,
4-bromo-1-methoxy-2-Naphthalenecarboxaldehyde,
SCHEMBL1774098,
ZNGLQDHNUMVTFL-UHFFFAOYSA-N,
4-Bromo-1-methoxy-2-naphthaldehyde,
CS-0059855,
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| Complexity | 232 |
| 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 | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.106g/mol |
| Monoisotopic Mass | 263.979g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number