| CAS Number | 58922-29-5 |
| Catalog Number | AG019F2S(AGN-PC-005SKJ) |
| Chemical Name | 2,4-Dihydroxy-3-methoxybenzaldehyde |
| IUPAC Name | 2,4-dihydroxy-3-methoxybenzaldehyde |
| InChI | InChI=1S/C8H8O4/c1-12-8-6(10)3-2-5(4-9)7(8)11/h2-4,10-11H,1H3 |
| InChI Key | HOFPWODHZJNTBF-UHFFFAOYSA-N |
| MDL Number | MFCD19301266 |
| Molecular Formula | C8H8O4 |
| Molecular Weight | 168.1467 |
| SMILES | OC1=C(C=O)C=CC(=C1OC)O |
| Synonyms | 2,4-dihydroxy-3-methoxybenzaldehyde,
58922-29-5,
Vanillinalkohol,
2,4-dihydroxy-3-methoxy-benzaldehyde,
SCHEMBL1005010,
MFCD19301266,
CS-0059753,
CID11275227,
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| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.148g/mol |
| Monoisotopic Mass | 168.042g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
Lot Number