| CAS Number | 23145-21-3 |
| Catalog Number | AG01AD13(AGN-PC-02A1Y1) |
| Chemical Name | 2-(2,2-Diethoxyethoxy)benzaldehyde |
| IUPAC Name | 2-(2,2-diethoxyethoxy)benzaldehyde |
| InChI | InChI=1S/C13H18O4/c1-3-15-13(16-4-2)10-17-12-8-6-5-7-11(12)9-14/h5-9,13H,3-4,10H2,1-2H3 |
| InChI Key | AVFQNQCCLWGODA-UHFFFAOYSA-N |
| MDL Number | MFCD21364936 |
| Molecular Formula | C13H18O4 |
| Molecular Weight | 238.2796 |
| SMILES | CCOC(OCC)COC1=C(C=O)C=CC=C1 |
| Synonyms | 2-(2,2-diethoxyethoxy)benzaldehyde,
23145-21-3,
SCHEMBL10586055,
ZINC95883658,
AKOS005216171,
NE51859,
2-formylphenoxy acetaldehyde diethylacetal,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 238.283g/mol |
| Monoisotopic Mass | 238.121g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 44.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number