| CAS Number | 364056-55-3 |
| Catalog Number | AG00I77S(AGN-PC-0WP087) |
| Chemical Name | TERT-BUTYL 2-HYDROXYETHYL(2-(2,2,2-TRIFLUOROACETAMIDO)ETHYL)CARBAMATE |
| IUPAC Name | tert-butyl N-(2-hydroxyethyl)-N-[2-[(2,2,2-trifluoroacetyl)amino]ethyl]carbamate |
| InChI | InChI=1S/C11H19F3N2O4/c1-10(2,3)20-9(19)16(6-7-17)5-4-15-8(18)11(12,13)14/h17H,4-7H2,1-3H3,(H,15,18) |
| InChI Key | SRWSHCXQMITJLY-UHFFFAOYSA-N |
| MDL Number | MFCD18206148 |
| Molecular Formula | C11H19F3N2O4 |
| Molecular Weight | 300.2748 |
| SMILES | CC(C)(C)OC(=O)N(CCO)CCNC(=O)C(F)(F)F |
| Synonyms | 364056-55-3,
tert-Butyl 2-hydroxyethyl(2-(2,2,2-trifluoroacetamido)ethyl)carbamate,
2,2,2-Trifluoro-N-[2-[(2-hydroxyethyl)-boc-amino]ethyl]-acetamide,
SCHEMBL6946470,
MFCD18206148,
ZINC168942714,
SRWSHCXQMITJLY-UHFFFAOYSA-N,
|
| Complexity | 340 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 300.13g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 300.278g/mol |
| Monoisotopic Mass | 300.13g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 78.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number