| CAS Number | 874583-03-6 |
| Catalog Number | AG00H3UE |
| Chemical Name | 2-(tert-butoxycarbonylamino)-2-(tetrahydrofuran-3-yl)acetic acid |
| IUPAC Name | 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(oxolan-3-yl)acetic acid |
| InChI | InChI=1S/C11H19NO5/c1-11(2,3)17-10(15)12-8(9(13)14)7-4-5-16-6-7/h7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14) |
| InChI Key | UKIWAWYDWRFUKS-UHFFFAOYSA-N |
| MDL Number | MFCD04115582 |
| Molecular Formula | C11H19NO5 |
| Molecular Weight | 245.2723 |
| SMILES | OC(=O)C(NC(=O)OC(C)(C)C)C1COCC1 |
| Synonyms | 874583-03-6,
[(tert-butoxycarbonyl)amino](tetrahydrofuran-3-yl)acetic acid,
2-((tert-Butoxycarbonyl)amino)-2-(tetrahydrofuran-3-yl)acetic acid,
2-(TERT-BUTOXYCARBONYLAMINO)-2-(TETRAHYDROFURAN-3-YL)ACETIC ACID,
tert-Butoxycarbonylamino-(tetrahydro-furan-3-yl)-acetic acid,
SCHEMBL5551400,
CTK7G9052,
UKIWAWYDWRFUKS-UHFFFAOYSA-N,
AKOS013464354,
AB20274,
FT-0715867,
T57255,
F8887-2847,
2-(BOC-AMINO)-2-(TETRAHYDROFURAN-3-YL)ACETIC ACID,
2-{[(tert-butoxy)carbonyl]amino}-2-(oxolan-3-yl)acetic acid,
2-(RS)-[(1,1-dimethylethyloxycarbonyl)amino]-2-(tetrahydrofuran-3-yl)acetic acid,
|
| Complexity | 297 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.275g/mol |
| Monoisotopic Mass | 245.126g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 84.9A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number