| CAS Number | 134594-22-2 |
| Catalog Number | AG009GKB(AGN-PC-00AN3S) |
| Chemical Name | 5-Methoxynaphthalene-1-carbaldehyde |
| IUPAC Name | 5-methoxynaphthalene-1-carbaldehyde |
| InChI | InChI=1S/C12H10O2/c1-14-12-7-3-5-10-9(8-13)4-2-6-11(10)12/h2-8H,1H3 |
| InChI Key | GZQNWVZECIRJHP-UHFFFAOYSA-N |
| MDL Number | MFCD17012505 |
| Molecular Formula | C12H10O2 |
| Molecular Weight | 186.2066 |
| SMILES | COC1=C2C(C(=CC=C2)C=O)=CC=C1 |
| Synonyms | 5-methoxynaphthalene-1-carbaldehyde,
134594-22-2,
5-Methoxynaphthalene-1-carboxaldehyde,
SCHEMBL2988767,
DTXSID60467832,
GZQNWVZECIRJHP-UHFFFAOYSA-N,
ZINC34604410,
1-Naphthalenecarboxaldehyde, 5-methoxy-,
DB-083969,
FT-0721744,
CID11513887,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.21g/mol |
| Monoisotopic Mass | 186.068g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
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