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Home Carboxys Isopropyl 1-(Boc-amino)-3,3-difluoro-cyclobutanecarboxylate

Isopropyl 1-(Boc-amino)-3,3-difluoro-cyclobutanecarboxylate

CAS No.:
1403766-72-2
Catalog Number:
AG00HVU2
Molecular Formula:
C13H21F2NO4
Molecular Weight:
293.3069
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Product Description
Catalog Number:
AG00HVU2
Chemical Name:
Isopropyl 1-(Boc-amino)-3,3-difluoro-cyclobutanecarboxylate
CAS Number:
1403766-72-2
Molecular Formula:
C13H21F2NO4
Molecular Weight:
293.3069
MDL Number:
MFCD23105830
IUPAC Name:
propan-2-yl 3,3-difluoro-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclobutane-1-carboxylate
InChI:
InChI=1S/C13H21F2NO4/c1-8(2)19-9(17)12(6-13(14,15)7-12)16-10(18)20-11(3,4)5/h8H,6-7H2,1-5H3,(H,16,18)
InChI Key:
FXGAOZAPAHGPPM-UHFFFAOYSA-N
SMILES:
CC(OC(=O)C1(NC(=O)OC(C)(C)C)CC(C1)(F)F)C
Properties
Complexity:
394  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.144g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
293.311g/mol
Monoisotopic Mass:
293.144g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties