Home Carbonyls Diethyl 2,2'-(1-(tert-butoxycarbonyl)-4,4-difluoropiperidine-3,5-diyl)diacetate

Diethyl 2,2'-(1-(tert-butoxycarbonyl)-4,4-difluoropiperidine-3,5-diyl)diacetate

CAS No.:
1864059-46-0
Catalog Number:
AG01D8RU
Molecular Formula:
C18H29F2NO6
Molecular Weight:
393.4228
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Product Description
Catalog Number:
AG01D8RU
Chemical Name:
Diethyl 2,2'-(1-(tert-butoxycarbonyl)-4,4-difluoropiperidine-3,5-diyl)diacetate
CAS Number:
1864059-46-0
Molecular Formula:
C18H29F2NO6
Molecular Weight:
393.4228
MDL Number:
MFCD28155108
IUPAC Name:
tert-butyl 3,5-bis(2-ethoxy-2-oxoethyl)-4,4-difluoropiperidine-1-carboxylate
InChI:
InChI=1S/C18H29F2NO6/c1-6-25-14(22)8-12-10-21(16(24)27-17(3,4)5)11-13(18(12,19)20)9-15(23)26-7-2/h12-13H,6-11H2,1-5H3
InChI Key:
DYSGPLDXODZVPR-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC1CN(CC(C1(F)F)CC(=O)OCC)C(=O)OC(C)(C)C
Properties
Complexity:
515  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
393.196g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
393.428g/mol
Monoisotopic Mass:
393.196g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties