Home Carboxys 4,4-difluoropiperidine-3-carboxylic acid hydrochloride

4,4-difluoropiperidine-3-carboxylic acid hydrochloride

CAS No.:
1780258-19-6
Catalog Number:
AG01BAL4
Molecular Formula:
C6H10ClF2NO2
Molecular Weight:
201.5989
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Product Description
Catalog Number:
AG01BAL4
Chemical Name:
4,4-difluoropiperidine-3-carboxylic acid hydrochloride
CAS Number:
1780258-19-6
Molecular Formula:
C6H10ClF2NO2
Molecular Weight:
201.5989
MDL Number:
MFCD28397686
IUPAC Name:
4,4-difluoropiperidine-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C6H9F2NO2.ClH/c7-6(8)1-2-9-3-4(6)5(10)11;/h4,9H,1-3H2,(H,10,11);1H
InChI Key:
KJNMUQFWEZPIRA-UHFFFAOYSA-N
SMILES:
OC(=O)C1CNCCC1(F)F.Cl
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.037g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
201.598g/mol
Monoisotopic Mass:
201.037g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties