Home Carboxys ethyl 3,3-difluoropyrrolidine-2-carboxylate hydrochloride

ethyl 3,3-difluoropyrrolidine-2-carboxylate hydrochloride

CAS No.:
168102-04-3
Catalog Number:
AG01EJ5O
Molecular Formula:
C7H12ClF2NO2
Molecular Weight:
215.6255
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Product Description
Catalog Number:
AG01EJ5O
Chemical Name:
ethyl 3,3-difluoropyrrolidine-2-carboxylate hydrochloride
CAS Number:
168102-04-3
Molecular Formula:
C7H12ClF2NO2
Molecular Weight:
215.6255
MDL Number:
MFCD18802305
IUPAC Name:
ethyl 3,3-difluoropyrrolidine-2-carboxylate;hydrochloride
InChI:
InChI=1S/C7H11F2NO2.ClH/c1-2-12-6(11)5-7(8,9)3-4-10-5;/h5,10H,2-4H2,1H3;1H
InChI Key:
CPQVZNDSPIWRLL-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1NCCC1(F)F.Cl
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.052g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
215.625g/mol
Monoisotopic Mass:
215.052g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties