200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1216735-73-7
1216735-73-7 | Pyrrolidine-3-carboxylic acid trifluoroacetate
CAS No: 1216735-73-7 Catalog No: AG01FA0A MDL No:
Product Description
Catalog Number:
AG01FA0A
Chemical Name:
Pyrrolidine-3-carboxylic acid trifluoroacetate
CAS Number:
1216735-73-7
Molecular Formula:
C7H10F3NO4
Molecular Weight:
229.1538
IUPAC Name:
pyrrolidine-3-carboxylic acid;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C5H9NO2.C2HF3O2/c7-5(8)4-1-2-6-3-4;3-2(4,5)1(6)7/h4,6H,1-3H2,(H,7,8);(H,6,7)
InChI Key:
XMIQMMOCQFIYFM-UHFFFAOYSA-N
SMILES:
OC(=O)C(F)(F)F.OC(=O)C1CNCC1
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.056g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
229.155g/mol
Monoisotopic Mass:
229.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Related Products
© 2019 Angene International Limited. All rights Reserved.