3,3-difluoropyrrolidine-2-carboxylic Acid

Base Information

• Chemical Name: 3,3-difluoropyrrolidine-2-carboxylic Acid
• CAS No.: 168102-06-5
• Molecular Formula: C5H7 F2 N O2
• Molecular Weight: 151.1113864
• Mol file: 168102-06-5.mol

Synonyms:3,3-difluoropyrrolidine-2-carboxylic Acid;168102-06-5;3,3-difluoroproline;1932019-87-8;SCHEMBL17337927;AKYUQSFIIOIBHO-UHFFFAOYSA-;AKYUQSFIIOIBHO-UHFFFAOYSA-N;AT19429;SB73833;3,3-difluoropyrrolidine-2-carboxylicAcid;EN300-119654;InChI=1/C5H7F2NO2/c6-5(7)1-2-8-3(5)4(9)10/h3,8H,1-2H2,(H,9,10)

Chemical Property of 3,3-difluoropyrrolidine-2-carboxylic Acid

Chemical Property:

• PSA: 49.33000
• LogP: 0.39700
• XLogP3: -2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 151.04448479
• Heavy Atom Count: 10
• Complexity: 160

Purity/Quality:

99% ^*data from raw suppliers

3,3-Difluoroproline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNC(C1(F)F)C(=O)O
• Uses: 3,3-Difluoroproline can be synthesized from N-Carbobenzoxy-β-alanine (C176180) and Mono-tert-butyl Malonate (M525030).