Home Carboxys Diethyl 1-benzyl-5,5-difluoro-4-oxopiperidine-2,3-dicarboxylate

Diethyl 1-benzyl-5,5-difluoro-4-oxopiperidine-2,3-dicarboxylate

CAS No.:
1881288-08-9
Catalog Number:
AG01D8RS
Molecular Formula:
C18H21F2NO5
Molecular Weight:
369.3598
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Product Description
Catalog Number:
AG01D8RS
Chemical Name:
Diethyl 1-benzyl-5,5-difluoro-4-oxopiperidine-2,3-dicarboxylate
CAS Number:
1881288-08-9
Molecular Formula:
C18H21F2NO5
Molecular Weight:
369.3598
MDL Number:
MFCD28967984
IUPAC Name:
diethyl 1-benzyl-5,5-difluoro-4-oxopiperidine-2,3-dicarboxylate
InChI:
InChI=1S/C18H21F2NO5/c1-3-25-16(23)13-14(17(24)26-4-2)21(11-18(19,20)15(13)22)10-12-8-6-5-7-9-12/h5-9,13-14H,3-4,10-11H2,1-2H3
InChI Key:
HXPWCBUJDZSZNB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1N(Cc2ccccc2)CC(C(=O)C1C(=O)OCC)(F)F
Properties
Complexity:
534  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.139g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
369.365g/mol
Monoisotopic Mass:
369.139g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties