Home Other Building Blocks 2-([(TERT-BUTOXY)CARBONYL]AMINO)-4,4-DIFLUOROPENTANOIC ACID

2-([(TERT-BUTOXY)CARBONYL]AMINO)-4,4-DIFLUOROPENTANOIC ACID

CAS No.:
1822586-02-6
Catalog Number:
AG01EKDI
Molecular Formula:
C10H17F2NO4
Molecular Weight:
253.2431
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Product Description
Catalog Number:
AG01EKDI
Chemical Name:
2-([(TERT-BUTOXY)CARBONYL]AMINO)-4,4-DIFLUOROPENTANOIC ACID
CAS Number:
1822586-02-6
Molecular Formula:
C10H17F2NO4
Molecular Weight:
253.2431
MDL Number:
MFCD24545997
IUPAC Name:
4,4-difluoro-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
InChI:
InChI=1S/C10H17F2NO4/c1-9(2,3)17-8(16)13-6(7(14)15)5-10(4,11)12/h6H,5H2,1-4H3,(H,13,16)(H,14,15)
InChI Key:
NLNAXEQQJLNSSA-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(C(=O)O)CC(F)(F)C
Properties
Complexity:
299  
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:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties