Back to Search
Glycine, N-[(Phenylmethoxy)Carbonyl]-, 2,5-Dioxo-1-Pyrrolidinyl Ester
CAS: 2899-60-7 | C14H14N2O6
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2899-60-7
Molecular Formula:
C14H14N2O6
Molecular Mass:
306.27 g/mol
Names and Synonyms:
Glycine, N-[(Phenylmethoxy)Carbonyl]-, 2,5-Dioxo-1-Pyrrolidinyl Ester
Glycine, N-[(phenylmethoxy)carbonyl]-, 2,5-dioxo-1-pyrrolidinyl ester
Succinimide, N-[(N-carboxyglycyl)oxy]-, benzyl ester
Carbamic acid, [2-[(2,5-dioxo-1-pyrrolidinyl)oxy]-2-oxoethyl]-, phenylmethyl ester
Glycine, N-carboxy-, N-benzyl ester, O-succinimido deriv.
Carbobenzoxyglycine N-hydroxysuccinimide ester
N-Carbobenzoxyglycine N-hydroxysuccinimide ester
N-(Benzyloxycarbonyl)glycine N-hydroxysuccinimide ester
2,5-Pyrrolidinedione, 1-[[[[(phenylmethoxy)carbonyl]amino]acetyl]oxy]-
N-(Benzyloxycarbonyl)glycine N-hydroxysuccinimidyl ester
N-Benzyloxycarbonyl-glycyl-N-hydroxysuccinimide ester
2,5-Dioxopyrrolidin-1-yl 2-[[(benzyloxy)carbonyl]amino]acetate
(2,5-Dioxopyrrolidin-1-yl) 2-(phenylmethoxycarbonylamino)acetate
Identifiers:
SMILES:
O=C(CN=C(O)OCc1ccccc1)ON1C(=O)CCC1=O
InChI:
InChI=1S/C14H14N2O6/c17-11-6-7-12(18)16(11)22-13(19)8-15-14(20)21-9-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,15,20)
Key Properties
Melting Point
113-114 °C
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 | 306.27 g/mol | CAS Common Chemistry |
| 306.2740000000001 g/mol | RDKit | |
| 306.08518616799995 g/mol | RDKit | |
| Canonical SMILES | O=C(OCC=1C=CC=CC1)NCC(=O)ON2C(=O)CCC2=O | CAS Common Chemistry |
| InChI | InChI=1S/C14H14N2O6/c17-11-6-7-12(18)16(11)22-13(19)8-15-14(20)21-9-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,15,20) | CAS Common Chemistry |
| InChI Key | InChIKey=WSCWXNZWFZXKEH-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 113-114 °C | CAS Common Chemistry |
| Name | Glycine, N-[(phenylmethoxy)carbonyl]-, 2,5-dioxo-1-pyrrolidinyl ester | CAS Common Chemistry |
| Heavy Atom Count | 22 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 105.5 Ų | RDKit |
| LogP | 0.7243999999999999 | RDKit |
| Molar Refractivity | 73.34080000000003 | RDKit |
