Home Other Building Blocks N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide hydrochloride

N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide hydrochloride

CAS No.:
1803587-36-1
Catalog Number:
AG01ACN6
Molecular Formula:
C7H12ClF3N2O
Molecular Weight:
232.6312
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Product Description
Catalog Number:
AG01ACN6
Chemical Name:
N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide hydrochloride
CAS Number:
1803587-36-1
Molecular Formula:
C7H12ClF3N2O
Molecular Weight:
232.6312
MDL Number:
MFCD27920050
IUPAC Name:
N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
InChI:
InChI=1S/C7H11F3N2O.ClH/c8-7(9,10)4-12-6(13)5-1-2-11-3-5;/h5,11H,1-4H2,(H,12,13);1H
InChI Key:
ZYWBNTIOVKGLSG-UHFFFAOYSA-N
SMILES:
O=C(C1CNCC1)NCC(F)(F)F.Cl
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.059g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
232.631g/mol
Monoisotopic Mass:
232.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties