Home Other Building Blocks 4-Piperidinol, 3,3-difluoro-1-(phenylmethyl)-

4-Piperidinol, 3,3-difluoro-1-(phenylmethyl)-

CAS No.:
1239596-53-2
Catalog Number:
AG000L9N
Molecular Formula:
C12H15F2NO
Molecular Weight:
227.2504
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Product Description
Catalog Number:
AG000L9N
Chemical Name:
4-Piperidinol, 3,3-difluoro-1-(phenylmethyl)-
CAS Number:
1239596-53-2
Molecular Formula:
C12H15F2NO
Molecular Weight:
227.2504
MDL Number:
MFCD18433631
IUPAC Name:
1-benzyl-3,3-difluoropiperidin-4-ol
InChI:
InChI=1S/C12H15F2NO/c13-12(14)9-15(7-6-11(12)16)8-10-4-2-1-3-5-10/h1-5,11,16H,6-9H2
InChI Key:
GQTXKSUYTZFNET-UHFFFAOYSA-N
SMILES:
OC1CCN(CC1(F)F)Cc1ccccc1
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.112g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.255g/mol
Monoisotopic Mass:
227.112g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties