| CAS Number | 86734-59-0 |
| Catalog Number | AG004NBI(AGN-PC-0061TL) |
| Chemical Name | 3-(Benzyloxy)-2-hydroxybenzaldehyde |
| IUPAC Name | 2-hydroxy-3-phenylmethoxybenzaldehyde |
| InChI | InChI=1S/C14H12O3/c15-9-12-7-4-8-13(14(12)16)17-10-11-5-2-1-3-6-11/h1-9,16H,10H2 |
| InChI Key | IDQPYNNNKOORPJ-UHFFFAOYSA-N |
| MDL Number | MFCD26385136 |
| Molecular Formula | C14H12O3 |
| Molecular Weight | 228.2433 |
| SMILES | C(C1=CC=CC=C1)OC=1C(=C(C=O)C=CC1)O |
| Synonyms | 86734-59-0,
Benzaldehyde, 2-hydroxy-3-(phenylmethoxy)-,
3-benzyloxy-2-hydroxy benzaldehyde,
3-(BENZYLOXY)-2-HYDROXYBENZALDEHYDE,
3-benzyloxy-2-hydroxybenzaldehyde,
SCHEMBL986050,
CTK3C6655,
DTXSID00461278,
IDQPYNNNKOORPJ-UHFFFAOYSA-N,
3-benzyloxy-2-hydroxy-benzaldehyde,
2-Hydroxy-3-(benzyloxy)benzaldehyde,
A1-06983,
2-hydroxy-3-phenylmethoxy-benzaldehyde,
CID11287616,
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| Complexity | 236 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.247g/mol |
| Monoisotopic Mass | 228.079g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number