| CAS Number | 483364-99-4 |
| Catalog Number | AG00I8S4(AGN-PC-0OAU7B) |
| Chemical Name | Benzyl 1-benzylaziridine-2-carboxylate |
| IUPAC Name | benzyl 1-benzylaziridine-2-carboxylate |
| InChI | InChI=1S/C17H17NO2/c19-17(20-13-15-9-5-2-6-10-15)16-12-18(16)11-14-7-3-1-4-8-14/h1-10,16H,11-13H2 |
| InChI Key | BFJUHMYAEJXNBP-UHFFFAOYSA-N |
| MDL Number | MFCD16620765 |
| Molecular Formula | C17H17NO2 |
| Molecular Weight | 267.3224 |
| SMILES | O=C(C1CN1Cc1ccccc1)OCc1ccccc1 |
| Synonyms | Benzyl 1-benzylaziridine-2-carboxylate,
483364-99-4,
SCHEMBL6487168,
BFJUHMYAEJXNBP-UHFFFAOYSA-N,
MFCD16620765,
FT-0726965,
N-benzyl-aziridine-2-carboxylic acid, benzyl ester,
A1-12666,
|
| Complexity | 319 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.328g/mol |
| Monoisotopic Mass | 267.126g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number