| CAS Number | 1015069-95-0 |
| Catalog Number | AG01B9AX |
| Chemical Name | tert-butyl N-(2-benzyl-3-hydroxypropyl)carbamate |
| IUPAC Name | tert-butyl N-(2-benzyl-3-hydroxypropyl)carbamate |
| InChI | InChI=1S/C15H23NO3/c1-15(2,3)19-14(18)16-10-13(11-17)9-12-7-5-4-6-8-12/h4-8,13,17H,9-11H2,1-3H3,(H,16,18) |
| InChI Key | MZROITKHJJJGJI-UHFFFAOYSA-N |
| MDL Number | MFCD18433216 |
| Molecular Formula | C15H23NO3 |
| Molecular Weight | 265.3480 |
| SMILES | CC(OC(NCC(CC1=CC=CC=C1)CO)=O)(C)C |
| Synonyms | tert-butyl N-(2-benzyl-3-hydroxypropyl)carbamate,
1015069-95-0,
SCHEMBL6835510,
MZROITKHJJJGJI-UHFFFAOYSA-N,
(tert-butoxy)-n-[3-hydroxy-2-benzylpropyl]carboxamide,
|
| Complexity | 267 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.168g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.353g/mol |
| Monoisotopic Mass | 265.168g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
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Certificate of Analysis
Lot Number