| CAS Number | 923256-42-2 |
| Catalog Number | AG019K84(AGN-PC-0WO23D) |
| Chemical Name | 4-[(Oxolan-2-yl)methoxy]benzaldehyde |
| IUPAC Name | 4-(oxolan-2-ylmethoxy)benzaldehyde |
| InChI | InChI=1S/C12H14O3/c13-8-10-3-5-11(6-4-10)15-9-12-2-1-7-14-12/h3-6,8,12H,1-2,7,9H2 |
| InChI Key | XNNTWUIEFDDWBO-UHFFFAOYSA-N |
| MDL Number | MFCD08691127 |
| Molecular Formula | C12H14O3 |
| Molecular Weight | 206.2378 |
| SMILES | O=CC1=CC=C(OCC2OCCC2)C=C1 |
| Synonyms | 4-[(oxolan-2-yl)methoxy]benzaldehyde,
4-(tetrahydrofuran-2-ylmethoxy)benzaldehyde,
923256-42-2,
4-((tetrahydrofuran-2-yl)methoxy)benzaldehyde,
4-[(Tetrahydrofuran-2-yl)methoxy]benzaldehyde,
AC1Q6PUK,
SCHEMBL4122451,
CTK7H9522,
XNNTWUIEFDDWBO-UHFFFAOYSA-N,
4-(oxolan-2-ylmethoxy)benzaldehyde,
AKOS000260212,
AKOS017265597,
MCULE-3020944830,
NE35722,
EN300-25895,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.241g/mol |
| Monoisotopic Mass | 206.094g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number