| CAS Number | 623943-75-9 |
| Catalog Number | AG01DZ9K(AGN-PC-0T480J) |
| Chemical Name | tert-Butyl 3-benzylimidazolidine-1-carboxylate |
| IUPAC Name | tert-butyl 3-benzylimidazolidine-1-carboxylate |
| InChI | InChI=1S/C15H22N2O2/c1-15(2,3)19-14(18)17-10-9-16(12-17)11-13-7-5-4-6-8-13/h4-8H,9-12H2,1-3H3 |
| InChI Key | OSIWDWJGKVEDRT-UHFFFAOYSA-N |
| MDL Number | MFCD24466955 |
| Molecular Formula | C15H22N2O2 |
| Molecular Weight | 262.3474 |
| SMILES | O=C(N1CCN(CC2=CC=CC=C2)C1)OC(C)(C)C |
| Synonyms | Tert-butyl 3-benzylimidazolidine-1-carboxylate,
623943-75-9,
SCHEMBL892981,
DTXSID00465877,
OSIWDWJGKVEDRT-UHFFFAOYSA-N,
MFCD24466955,
ZINC95616770,
AKOS022173632,
FCH1660083,
AK138094,
AM807736,
AJ-132809,
AX8259643,
1-Benzyl-3-(tert-butoxycarbonyl)imidazolidine,
CID11436961,
|
| Complexity | 306 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.168g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 262.353g/mol |
| Monoisotopic Mass | 262.168g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 32.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
|
|
Hazard statements
|
H315-H319-H335
|
|
Packing Group
|
|
|
Precautionary statements
|
P261-P305+P351+P338
|
|
UN Code
|
|
Certificate of Analysis
Lot Number