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1067914-83-3 | tert-Butyl 3,3-difluoro-4,4-dihydroxypiperidine-1-carboxylate
CAS No: 1067914-83-3 Catalog No: AG0039Q9 MDL No:MFCD18072968
Product Description
Catalog Number:
AG0039Q9
Chemical Name:
tert-Butyl 3,3-difluoro-4,4-dihydroxypiperidine-1-carboxylate
CAS Number:
1067914-83-3
Molecular Formula:
C10H17F2NO4
Molecular Weight:
253.2431
MDL Number:
MFCD18072968
IUPAC Name:
tert-butyl 3,3-difluoro-4,4-dihydroxypiperidine-1-carboxylate
InChI:
InChI=1S/C10H17F2NO4/c1-8(2,3)17-7(14)13-5-4-10(15,16)9(11,12)6-13/h15-16H,4-6H2,1-3H3
InChI Key:
WQBMVRTXKYXMKT-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(C(C1)(F)F)(O)O)OC(C)(C)C
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.113g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
253.246g/mol
Monoisotopic Mass:
253.113g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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