| CAS Number | 1076197-03-9 |
| Catalog Number | AG00HB0V(AGN-PC-0WQX0D) |
| Chemical Name | (R,S)-Boc-3-amino-2-(naphthalen-1-ylmethyl)-propionic acid |
| IUPAC Name | 2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-3-naphthalen-1-ylpropanoic acid |
| InChI | InChI=1S/C19H23NO4/c1-19(2,3)24-18(23)20-12-15(17(21)22)11-14-9-6-8-13-7-4-5-10-16(13)14/h4-10,15H,11-12H2,1-3H3,(H,20,23)(H,21,22) |
| InChI Key | WXQGOWCFXXGOLZ-UHFFFAOYSA-N |
| MDL Number | MFCD11226810 |
| Molecular Formula | C19H23NO4 |
| Molecular Weight | 329.3902 |
| SMILES | CC(OC(NCC(C(O)=O)CC1=C2C(C=CC=C2)=CC=C1)=O)(C)C |
| Synonyms | (R,S)-Boc-3-amino-2-(naphthalen-1-ylmethyl)-propionic acid,
1076197-03-9,
3-((tert-Butoxycarbonyl)amino)-2-(naphthalen-1-ylmethyl)propanoic acid,
4382AH,
MFCD11226810,
AKOS027326157,
C19H23NO4,
|
| Complexity | 443 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 329.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 329.396g/mol |
| Monoisotopic Mass | 329.163g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 75.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number