| CAS Number | 61227-36-9 |
| Catalog Number | AG01EWNF(AGN-PC-0KZBYL) |
| Chemical Name | 2-(Benzyloxy)-6-methoxybenzaldehyde |
| IUPAC Name | 2-methoxy-6-phenylmethoxybenzaldehyde |
| InChI | InChI=1S/C15H14O3/c1-17-14-8-5-9-15(13(14)10-16)18-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3 |
| InChI Key | DSHQZHVVWLPOBE-UHFFFAOYSA-N |
| MDL Number | MFCD02380392 |
| Molecular Formula | C15H14O3 |
| Molecular Weight | 242.2699 |
| SMILES | C1(C=CC=C(OC)C=1C=O)OCC1=CC=CC=C1 |
| Synonyms | 2-benzyloxy-6-methoxybenzaldehyde,
2-(benzyloxy)-6-methoxybenzaldehyde,
61227-36-9,
AC1MVN1A,
SCHEMBL751846,
CTK2E4355,
DTXSID80395724,
DSHQZHVVWLPOBE-UHFFFAOYSA-N,
2-benzyloxy-6-methoxy-benzaldehyde,
ZINC5662034,
2-methoxy-6-phenylmethoxybenzaldehyde,
AKOS030576175,
2-methoxy-6-(phenylmethoxy)benzaldehyde,
Benzaldehyde, 2-methoxy-6-(phenylmethoxy)-,
2-methoxy-6-phenylmethoxy-benzaldehyde,
CID3735479,
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| Complexity | 248 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.274g/mol |
| Monoisotopic Mass | 242.094g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
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Certificate of Analysis
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