Home Carboxys 1-tert-butyl2-methyl5,5-difluoropiperidine-1,2-dicarboxylate-B28292

1-tert-butyl2-methyl5,5-difluoropiperidine-1,2-dicarboxylate-B28292

CAS No.:
1255663-86-5
Catalog Number:
AG019G36
Molecular Formula:
C12H19F2NO4
Molecular Weight:
279.2804
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Product Description
Catalog Number:
AG019G36
Chemical Name:
1-tert-butyl2-methyl5,5-difluoropiperidine-1,2-dicarboxylate-B28292
CAS Number:
1255663-86-5
Molecular Formula:
C12H19F2NO4
Molecular Weight:
279.2804
MDL Number:
MFCD18433617
IUPAC Name:
1-O-tert-butyl 2-O-methyl 5,5-difluoropiperidine-1,2-dicarboxylate
InChI:
InChI=1S/C12H19F2NO4/c1-11(2,3)19-10(17)15-7-12(13,14)6-5-8(15)9(16)18-4/h8H,5-7H2,1-4H3
InChI Key:
LRQDHHWURPHLBJ-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCC(CN1C(=O)OC(C)(C)C)(F)F
Properties
Complexity:
365  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.128g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.284g/mol
Monoisotopic Mass:
279.128g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties