| CAS Number | 1182333-70-5 |
| Catalog Number | AG01B6DF |
| Chemical Name | 4-(oxolan-3-yloxy)benzaldehyde |
| IUPAC Name | 4-(oxolan-3-yloxy)benzaldehyde |
| InChI | InChI=1S/C11H12O3/c12-7-9-1-3-10(4-2-9)14-11-5-6-13-8-11/h1-4,7,11H,5-6,8H2 |
| InChI Key | JCZZBIQMOZFUGB-UHFFFAOYSA-N |
| MDL Number | MFCD18365741 |
| Molecular Formula | C11H12O3 |
| Molecular Weight | 192.2112 |
| SMILES | C1COCC1OC2=CC=C(C=C2)C=O |
| Synonyms | 4-((tetrahydrofuran-3-yl)oxy)benzaldehyde,
1182333-70-5,
rac-4-(Tetrahydrofuran-3-yloxy)benzaldehyde,
SCHEMBL924708,
4-(oxolan-3-yloxy)benzaldehyde,
JCZZBIQMOZFUGB-UHFFFAOYSA-N,
MFCD18365741,
AKOS012867312,
F2158-1992,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.214g/mol |
| Monoisotopic Mass | 192.079g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number