Home Carboxys 5,5-difluoropiperidine-3-carboxylicacidhydrochloride-D28091

5,5-difluoropiperidine-3-carboxylicacidhydrochloride-D28091

CAS No.:
1255666-96-6
Catalog Number:
AG019G28
Molecular Formula:
C6H9F2NO2
Molecular Weight:
165.1380
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Product Description
Catalog Number:
AG019G28
Chemical Name:
5,5-difluoropiperidine-3-carboxylicacidhydrochloride-D28091
CAS Number:
1255666-96-6
Molecular Formula:
C6H9F2NO2
Molecular Weight:
165.1380
MDL Number:
MFCD21601872
IUPAC Name:
5,5-difluoropiperidine-3-carboxylic acid
InChI:
InChI=1S/C6H9F2NO2/c7-6(8)1-4(5(10)11)2-9-3-6/h4,9H,1-3H2,(H,10,11)
InChI Key:
WYXRBEZTQNOEHT-UHFFFAOYSA-N
SMILES:
OC(=O)C1CNCC(C1)(F)F
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.06g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.14g/mol
Monoisotopic Mass:
165.06g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.1  
Properties