| CAS Number | 923236-97-9 |
| Catalog Number | AG019N8G |
| Chemical Name | 7-propoxy-2H-chromene-3-carbaldehyde |
| IUPAC Name | 7-propoxy-2H-chromene-3-carbaldehyde |
| InChI | InChI=1S/C13H14O3/c1-2-5-15-12-4-3-11-6-10(8-14)9-16-13(11)7-12/h3-4,6-8H,2,5,9H2,1H3 |
| InChI Key | BDIAPSQKXAYRQL-UHFFFAOYSA-N |
| MDL Number | MFCD08445010 |
| Molecular Formula | C13H14O3 |
| Molecular Weight | 218.2485 |
| SMILES | CCCOC1=CC2=C(C=C(C=O)CO2)C=C1 |
| Synonyms | 7-propoxy-2H-chromene-3-carbaldehyde,
923236-97-9,
AC1Q2YH7,
CTK6E6143,
ZINC20284960,
AKOS009113614,
MCULE-4225485091,
EN300-39671,
|
| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.252g/mol |
| Monoisotopic Mass | 218.094g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number