Home Carboxys ethyl 4,4-difluoropiperidine-3-carboxylate hydrochloride

ethyl 4,4-difluoropiperidine-3-carboxylate hydrochloride

CAS No.:
1780607-50-2
Catalog Number:
AG01BRT3
Molecular Formula:
C8H14ClF2NO2
Molecular Weight:
229.6521
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Product Description
Catalog Number:
AG01BRT3
Chemical Name:
ethyl 4,4-difluoropiperidine-3-carboxylate hydrochloride
CAS Number:
1780607-50-2
Molecular Formula:
C8H14ClF2NO2
Molecular Weight:
229.6521
MDL Number:
MFCD30535876
IUPAC Name:
ethyl 4,4-difluoropiperidine-3-carboxylate;hydrochloride
InChI:
InChI=1S/C8H13F2NO2.ClH/c1-2-13-7(12)6-5-11-4-3-8(6,9)10;/h6,11H,2-5H2,1H3;1H
InChI Key:
LRUJWTRXGIHFEQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CNCCC1(F)F.Cl
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.068g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
229.652g/mol
Monoisotopic Mass:
229.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties