Back to Search
N-Α-Benzyloxycarbonyl-L-Lysine
CAS: 2212-75-1 | C14H20N2O4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2212-75-1
Molecular Formula:
C14H20N2O4
Molecular Mass:
280.32 g/mol
Names and Synonyms:
N-Α-Benzyloxycarbonyl-L-Lysine
L-Lysine, N2-[(phenylmethoxy)carbonyl]-
Lysine, N2-carboxy-, N2-benzyl ester, L-
Lysine, N2-carboxy-, N-benzyl ester
L-Lysine, N2-carboxy-, N-benzyl ester
N2-[(Phenylmethoxy)carbonyl]-L-lysine
N-α-Benzyloxycarbonyl-L-lysine
α-Carbobenzoxy-L-lysine
Nα-(Benzyloxycarbonyl)lysine
α-N-Benzyloxycarbonyl-L-lysine
N2-Carboxylysine N2-benzyl ester
N-α-Carbobenzoxy-L-lysine
N2-Benzyloxycarbonyllysine
N2-Benzyloxycarbonyl-L-lysine
N-α-Z-L-Lysine
Nα-Cbz-Lysine
Cbz-L-Lys-OH
(2S)-6-Azaniumyl-2-(phenylmethoxycarbonylamino)hexanoate
Identifiers:
SMILES:
NCCCC[C@H](N=C(O)OCc1ccccc1)C(=O)O
InChI:
InChI=1S/C14H20N2O4/c15-9-5-4-8-12(13(17)18)16-14(19)20-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,15H2,(H,16,19)(H,17,18)/t12-/m0/s1
Key Properties
Melting Point
248-250 °C @ Solvent: Water
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 280.32 g/mol | CAS Common Chemistry |
| 280.324 g/mol | RDKit | |
| 280.14230712 g/mol | RDKit | |
| Canonical SMILES | O=C(OCC=1C=CC=CC1)NC(C(=O)O)CCCCN | CAS Common Chemistry |
| InChI | InChI=1S/C14H20N2O4/c15-9-5-4-8-12(13(17)18)16-14(19)20-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,15H2,(H,16,19)(H,17,18)/t12-/m0/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=OJTJKAUNOLVMDX-LBPRGKRZSA-N | CAS Common Chemistry |
| Melting Point | 248-250 °C @ Solvent: Water | CAS Common Chemistry |
| Name | N-α-Benzyloxycarbonyl-L-lysine | CAS Common Chemistry |
| Heavy Atom Count | 20 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 8 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 105.14 Ų | RDKit |
| LogP | 1.6994000000000002 | RDKit |
| Molar Refractivity | 75.62400000000004 | RDKit |
