| CAS Number | 858457-19-9 |
| Catalog Number | AG004RB6(AGN-PC-0JE1VV) |
| Chemical Name | 1,8-Dihydroxy-2-Naphthaldehyde |
| IUPAC Name | 1,8-dihydroxynaphthalene-2-carbaldehyde |
| InChI | InChI=1S/C11H8O3/c12-6-8-5-4-7-2-1-3-9(13)10(7)11(8)14/h1-6,13-14H |
| InChI Key | QBXCVGGCXRBENM-UHFFFAOYSA-N |
| MDL Number | MFCD24674376 |
| Molecular Formula | C11H8O3 |
| Molecular Weight | 188.1794 |
| SMILES | O=CC1=CC=C2C=CC=C(O)C2=C1O |
| Synonyms | 1,8-Dihydroxy-2-naphthaldehyde,
858457-19-9,
1,8-Dihydroxynaphthalene-2-carbaldehyde,
2-Naphthalenecarboxaldehyde, 1,8-dihydroxy-,
SCHEMBL10331763,
CTK2I3910,
DTXSID60826869,
ZINC90669330,
AKOS030528728,
FCH1994325,
J3.501.261C,
D19255,
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| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.182g/mol |
| Monoisotopic Mass | 188.047g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 57.5A^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