| CAS Number | 1609400-63-6 |
| Catalog Number | AG00J3VE(AGN-PC-0WB7SH) |
| Chemical Name | 2-(2-Morpholinoethoxy)benzaldehyde hydrochloride |
| IUPAC Name | 2-(2-morpholin-4-ylethoxy)benzaldehyde;hydrochloride |
| InChI | InChI=1S/C13H17NO3.ClH/c15-11-12-3-1-2-4-13(12)17-10-7-14-5-8-16-9-6-14;/h1-4,11H,5-10H2;1H |
| InChI Key | JPLDNISOZSJXGW-UHFFFAOYSA-N |
| MDL Number | MFCD13186486 |
| Molecular Formula | C13H18ClNO3 |
| Molecular Weight | 271.7399 |
| SMILES | N1(CCOCC1)CCOC1=CC=CC=C1C=O.Cl |
| Synonyms | 1609400-63-6,
2-(2-Morpholinoethoxy)benzaldehyde hydrochloride,
2-[2-(4-Morpholinyl)ethoxy]benzaldehyde hydrochloride,
ZX-CM017456,
MFCD13186486,
AKOS027426608,
2-[2-(Morpholino)ethoxy]benzaldehyde hydrochloride,
|
| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.741g/mol |
| Monoisotopic Mass | 271.098g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number