Home Other Building Blocks METHYL 2-([(TERT-BUTOXY)CARBONYL]AMINO)-3-(4-FLUOROPHENYL)PROPANOATE

METHYL 2-([(TERT-BUTOXY)CARBONYL]AMINO)-3-(4-FLUOROPHENYL)PROPANOATE

CAS No.:
86129-35-3
Catalog Number:
AG01DU4X
Molecular Formula:
C15H20FNO4
Molecular Weight:
297.3220
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Product Description
Catalog Number:
AG01DU4X
Chemical Name:
METHYL 2-([(TERT-BUTOXY)CARBONYL]AMINO)-3-(4-FLUOROPHENYL)PROPANOATE
CAS Number:
86129-35-3
Molecular Formula:
C15H20FNO4
Molecular Weight:
297.3220
MDL Number:
MFCD24473468
IUPAC Name:
methyl 3-(4-fluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
InChI:
InChI=1S/C15H20FNO4/c1-15(2,3)21-14(19)17-12(13(18)20-4)9-10-5-7-11(16)8-6-10/h5-8,12H,9H2,1-4H3,(H,17,19)
InChI Key:
CSKFYKNIJQMDLZ-UHFFFAOYSA-N
SMILES:
COC(=O)C(Cc1ccc(cc1)F)NC(=O)OC(C)(C)C
Properties
Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.138g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
297.326g/mol
Monoisotopic Mass:
297.138g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties