| CAS Number | 54280-77-2 |
| Catalog Number | AG019XE4(AGN-PC-0WOC37) |
| Chemical Name | 2-(Cyclopropylmethoxy)benzaldehyde |
| IUPAC Name | 2-(cyclopropylmethoxy)benzaldehyde |
| InChI | InChI=1S/C11H12O2/c12-7-10-3-1-2-4-11(10)13-8-9-5-6-9/h1-4,7,9H,5-6,8H2 |
| InChI Key | YPXZBUQPDJHULR-UHFFFAOYSA-N |
| MDL Number | MFCD11156430 |
| Molecular Formula | C11H12O2 |
| Molecular Weight | 176.2118 |
| SMILES | O=CC1=C(OCC2CC2)C=CC=C1 |
| Synonyms | 2-(cyclopropylmethoxy)benzaldehyde,
54280-77-2,
AC1Q6PRW,
SCHEMBL636591,
CTK7I0049,
(2-cyclopropylmethoxy)benzaldehyde,
YPXZBUQPDJHULR-UHFFFAOYSA-N,
ZINC20079269,
AKOS000260113,
MCULE-5987271632,
NE41794,
EN300-54769,
|
| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.215g/mol |
| Monoisotopic Mass | 176.084g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number