| CAS Number | 1255237-45-6 |
| Catalog Number | AG009C7X(AGN-PC-0WQVD2) |
| Chemical Name | ethyl 2-amino-3-(oxolan-3-yl)propanoate |
| IUPAC Name | 1-(oxolan-3-yl)-3-propoxybut-3-en-2-amine |
| InChI | InChI=1S/C11H21NO2/c1-3-5-14-9(2)11(12)7-10-4-6-13-8-10/h10-11H,2-8,12H2,1H3 |
| InChI Key | YHQSWLUGZGRKOO-UHFFFAOYSA-N |
| MDL Number | MFCD22571221 |
| Molecular Formula | C9H17NO3 |
| Molecular Weight | 187.2362 |
| SMILES | CCOC(C(CC1COCC1)N)=O |
| Synonyms | 3-propoxy-1-(tetrahydrofuran-3-yl)but-3-en-2-amine,
1255237-45-6,
CS-M1473,
CS-13929,
|
| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.157g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.294g/mol |
| Monoisotopic Mass | 199.157g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number