trans-4-Boc-amino-1-benzylpyrrolidine-3-carboxylic acid

Base Information

• Chemical Name: trans-4-Boc-amino-1-benzylpyrrolidine-3-carboxylic acid
• CAS No.: 628725-28-0
• Molecular Formula: C17H24 N2 O4
• Molecular Weight: 320.38
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID40592070
• Mol file: 628725-28-0.mol

Synonyms:628725-28-0;trans-4-Boc-amino-1-benzylpyrrolidine-3-carboxylic acid;trans-4-Boc-Amino-1-Benzyl-pyrrolidine-3-carboxylic acid;(3S,4R)-1-benzyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-3-carboxylic acid;trans-racemic-1-Benzyl-4-tert-butoxycarbonylamino-pyrrolidine-3-carboxylic acid;trans-4-Boc-Amino-1-Benzyl-pyrrolidine-3-carboxylicacid;(3S,4R)-1-benzyl-4-[(tert-butoxycarbonyl)amino]pyrrolidine-3-carboxylic acid;(3S,4R)-1-benzyl-4-((tert-butoxycarbonyl)amino)pyrrolidine-3-carboxylic acid;DTXSID40592070;MFCD06658995;(3S,4R)-1-benzyl-4-(tert-butoxycarbonylamino)pyrrolidine-3-carboxylic acid;AKOS025311185;trans-1-Benzyl-4-((tert-butoxycarbonyl)amino)pyrrolidine-3-carboxylic acid;AC-6703;AS-36658;A8684;CS-0454449;(3S,4R)-1-benzyl-4-(tert-butoxycarbonyl)pyrrolidine-3-carboxylic acid;trans-1-Benzyl-4-((tert-butoxycarbonyl)amino)pyrrolidine-3-carboxylicacid;1932130-59-0

Chemical Property of trans-4-Boc-amino-1-benzylpyrrolidine-3-carboxylic acid

Chemical Property:

• Vapor Pressure: 5.57E-10mmHg at 25°C
• Melting Point: 198.1-198.6°C
• Boiling Point: 478.9°C at 760 mmHg
• Flash Point: 243.4°C
• PSA: 78.87000
• Density: 1.2g/cm³
• LogP: 2.42510
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 320.17360725
• Heavy Atom Count: 23
• Complexity: 427

Purity/Quality:

98%min ^*data from raw suppliers

trans-racemic-1-Benzyl-4-tert-butoxycarbonylamino-pyrrolidine-3-carboxylic acid Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC1CN(CC1C(=O)O)CC2=CC=CC=C2
• Isomeric SMILES: CC(C)(C)OC(=O)N[C@H]1CN(C[C@@H]1C(=O)O)CC2=CC=CC=C2