3D Mol Similar

Cbz-Pro-Leu-OMe

: Iupac Name：benzyl (2S)-2-[[(2S)-1-methoxy-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate; CAS No.: 2873-37-2; Molecular Weight：376.44672; Modify Date.: 2022-11-24 02:45

Request For Quotation

1. Names and Identifiers

: 1.1 Name; Cbz-Pro-Leu-OMe; 1.2 Synonyms; (S)-Benzyl 2-(((S)-1-methoxy-4-methyl-1-oxopentan-2-yl)carbamoyl)pyrrolidine-1-carboxylate 1-[(Phenylmethoxy)carbonyl]-L-prolyl-L-leucine methyl ester Benzyloxycarbonyl-L-prolyl-leucine methyl ester Cbz-L-proline-L-leucine methyl ester Cbz-L-Pro-L-Leu methyl ester Cbz-Pro-Leu-OMe Leucine, 1-[(phenylmethoxy)carbonyl]-L-prolyl-, methyl ester Leucine, N-(1-carboxy-L-prolyl)-, benzyl methyl ester Leucine, N-(1-carboxy-L-prolyl)-, benzyl methyl ester, L- -L-leucine methyl ester L-Leucine, 1-[(phenylmethoxy)carbonyl]-L-prolyl-, methyl ester L-Leucine, N-[1-[(phenylmethoxy)carbonyl]-L-prolyl]-, methyl ester Methyl 1-[(benzyloxy)carbonyl]-L-prolylleucinate N-(Benzyloxycarbonyl)prolylleucine methyl ester N-Carbobenzoxy-L-prolyl-L-leucine methyl ester N-Carbobenzoxy-L-prolyl-L-leucinemethyl ester N-Carbobenzoxy-L-prolyl-L-leucinemethyl ester/Cbz-pro-Leu-Ome N-Cbz-L-Pro-L-Leu-OMe Z-Pro-Leu-OCH3 Z-Pro-Leu-OMe; View all

1.3 CAS No.: 2873-37-2

1.4 CID: 9976822

1.5 Molecular Formula: C20H28N2O5 (isomer)

1.6 Inchi: InChI=1S/C20H28N2O5/c1-14(2)12-16(19(24)26-3)21-18(23)17-10-7-11-22(17)20(25)27-13-15-8-5-4-6-9-15/h4-6,8-9,14,16-17H,7,10-13H2,1-3H3,(H,21,23)/t16-,17-/m0/s1

1.7 InChIkey: NCECLGUVJMKAPA-IRXDYDNUSA-N

1.8 Canonical Smiles: CC(C)CC(C(=O)OC)NC(=O)C1CCCN1C(=O)OCC2=CC=CC=C2

1.9 Isomers Smiles: CC(C)C[C@@H](C(=O)OC)NC(=O)[C@@H]1CCCN1C(=O)OCC2=CC=CC=C2

2. Properties

2.1 Density: 1.171±0.06 g/cm3(Predicted)

2.1 Melting point: 76.5-78.0 °C @ Solvent: Ethyl acetate, Hexane

2.1 Boiling point: 536.3±50.0 °C(Predicted)

2.1 Refractive index: 1.533

2.1 Flash Point: 278.2±30.1 °C

2.1 PSA: 88.43000

2.1 logP: 2.32

2.1 pKa: 13.69±0.20(Predicted)

3. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s)	no data available
Signal word	no data available
Hazard statement(s)	no data available
Precautionary statement(s)
Prevention	no data available
Response	no data available
Storage	no data available
Disposal	no data available

2.3 Other hazards which do not result in classification

no data available

View all

4. Synthesis Route

2873-37-2Total: 9 Synthesis Route

61-90-5 648 Suppliers

2873-37-2 3 Suppliers

Literatures:
Hoogwater, D. A.; Peereboom, M. Tetrahedron, 1990 , vol. 46, # 15 p. 5325 - 5332
Yield: null

147-85-3 620 Suppliers

2873-37-2 3 Suppliers

Literatures:
Hoogwater, D. A.; Peereboom, M. Tetrahedron, 1990 , vol. 46, # 15 p. 5325 - 5332
Yield: null

501-53-1 149 Suppliers

2873-37-2 3 Suppliers

Literatures:
Hoogwater, D. A.; Peereboom, M. Tetrahedron, 1990 , vol. 46, # 15 p. 5325 - 5332
Yield: null

View all

5. Precursor and Product

precursor:

501-53-1

147-85-3

1059596-61-0

61-90-5

2666-93-5

1148-11-4

7517-19-3

627-36-1

3304-59-4

product :

14485-80-4

1634-90-8

6. Computational chemical data

Molecular Weight: 376.44672g/mol
Molecular Formula: C₂₀H₂₈N₂O₅
Compound Is Canonicalized: True
XLogP3-AA: null
Exact Mass: 376.19982200
Monoisotopic Mass: 376.19982200
Complexity: 517
Rotatable Bond Count: 9
Hydrogen Bond Donor Count: 1
Hydrogen Bond Acceptor Count: 5
Topological Polar Surface Area: 84.9
Heavy Atom Count: 27
Defined Atom Stereocenter Count: 2
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADceB7OAAAAAAAAAAAAAAAAAAAAWAAAAAwAAAAAAAAAAABAAAAHgAQAAAADSjhmAYyCIPABACIAiHSGAACAAAgAAAIiIGICIgKZjKAsTidMAAk1gGYqAeYwSAOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

7. Recommended Suppliers

Global2SuppliersView all >>

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Cbz-Pro-Leu-OMe

Purity:99%Packing: 200kg/bag FOB
Price: 100 USD/kg
Time: 2024/11/15

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Angene International Limited

Products:lab reagents, intermediates, bulk commodities, agro-chemicals, natural ingredients and active pharmaceutical ingredients (APIs)
Tel:852-852-81916999

(S)-Benzyl 2-(((S)-1-methoxy-4-methyl-1-oxopentan-2-yl)carbamoyl)pyrrolidine-1-carboxylate