| CAS Number | 947274-14-8 |
| Catalog Number | AG00IIHN(AGN-PC-0WOKWW) |
| Chemical Name | 3-(3-Methoxypropoxy)benzaldehyde |
| IUPAC Name | 3-(3-methoxypropoxy)benzaldehyde |
| InChI | InChI=1S/C11H14O3/c1-13-6-3-7-14-11-5-2-4-10(8-11)9-12/h2,4-5,8-9H,3,6-7H2,1H3 |
| InChI Key | FBINSGQXGIWVAH-UHFFFAOYSA-N |
| MDL Number | MFCD12798838 |
| Molecular Formula | C11H14O3 |
| Molecular Weight | 194.2271 |
| SMILES | COCCCOC1=CC(C=O)=CC=C1 |
| Synonyms | 3-(3-methoxypropoxy)benzaldehyde,
947274-14-8,
AC1Q4FUP,
SCHEMBL695627,
CTK7B3163,
3-(3-methoxypropoxyl)benzaldehyde,
FBINSGQXGIWVAH-UHFFFAOYSA-N,
ZINC37506383,
NE15564,
3-(3-methoxypropoxy)benzaldehyde, AldrichCPR,
EN300-59629,
|
| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.23g/mol |
| Monoisotopic Mass | 194.094g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number