(S)-1-(tert-butoxycarbonyl)-4-oxopiperidine-2-carboxylic acid

Base Information

• Chemical Name: (S)-1-(tert-butoxycarbonyl)-4-oxopiperidine-2-carboxylic acid
• CAS No.: 198646-60-5
• Molecular Formula: C₁₁H₁₇NO₅
• Molecular Weight: 243.26
• Hs Code.: 29333990
• European Community (EC) Number: 695-393-4
• Nikkaji Number: J904.215F
• Wikidata: Q76416052
• Mol file: 198646-60-5.mol

Synonyms:198646-60-5;(S)-1-(tert-butoxycarbonyl)-4-oxopiperidine-2-carboxylic acid;(S)-1-Boc-4-oxopiperidine-2-carboxylic acid;(S)-(-)-1-BOC-4-OXOPIPERIDINE-2-CARBOXYLIC ACID;(2S)-1-[(tert-butoxy)carbonyl]-4-oxopiperidine-2-carboxylic acid;(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxopiperidine-2-carboxylic acid;(S)-1-(Boc)-4-Oxopiperidine-2-carboxylic acid;MFCD03094867;(S)-1-N-Boc-4-oxo-piperidine-2-carboxylic acid;SCHEMBL4547486;GPBCBXYUAJQMQM-QMMMGPOBSA-N;(S)-1-(tert-butoxycarbonyl)-4-oxopiperidine-2-carboxylicacid;(2S)-1-(tert-butoxycarbonyl)-4-oxopiperidine-2-carboxylic acid;AMY34387;BCP16517;AKOS015897920;AKOS015949194;CS-W001492;(S)-1-BOC-4-OXOPIPECOLIC ACID;DS-15386;A4352;BB 0261630;(S)-1-Boc-4-oxopiperidine-2-carboxylic acid, 95%;(2S)-4-Oxopiperidine-2-carboxylic acid, N-BOC protected;(2S)-4-oxo-piperidine-1,2-dicarboxylic acid 1-tert-butyl ester;(S)-1-BOC-4-OXOPIPERIDINE-2-CARBOXYLIC ACID

Chemical Property of (S)-1-(tert-butoxycarbonyl)-4-oxopiperidine-2-carboxylic acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 126-128℃
• Refractive Index: 1.508
• Boiling Point: 403.618 °C at 760 mmHg
• PKA: 3.95±0.20(Predicted)
• Flash Point: 197.901 °C
• PSA: 83.91000
• Density: 1.258 g/cm³
• LogP: 0.97750
• Storage Temp.: Inert atmosphere,Room Temperature
• Sensitive.: Air & Moisture Sensitive
• Solubility.: Soluble (12 g/L) (25°C)
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 243.11067264
• Heavy Atom Count: 17
• Complexity: 344

Purity/Quality:

98%,99%, ^*data from raw suppliers

(S)-1-Boc-4-oxopiperidine-2-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCC(=O)CC1C(=O)O
• Isomeric SMILES: CC(C)(C)OC(=O)N1CCC(=O)C[C@H]1C(=O)O
• Uses: It is a fine chemical and synthetic intermediate.