Home Carbonyls 3-{[(tert-butoxy)carbonyl]amino}-2,2-dimethyl-3-phenylpropanoic acid

3-{[(tert-butoxy)carbonyl]amino}-2,2-dimethyl-3-phenylpropanoic acid

CAS No.:
208397-32-4
Catalog Number:
AG01BB8Q
Molecular Formula:
C16H23NO4
Molecular Weight:
293.3581
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Product Description
Catalog Number:
AG01BB8Q
Chemical Name:
3-{[(tert-butoxy)carbonyl]amino}-2,2-dimethyl-3-phenylpropanoic acid
CAS Number:
208397-32-4
Molecular Formula:
C16H23NO4
Molecular Weight:
293.3581
MDL Number:
MFCD24394488
IUPAC Name:
2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid
InChI:
InChI=1S/C16H23NO4/c1-15(2,3)21-14(20)17-12(16(4,5)13(18)19)11-9-7-6-8-10-11/h6-10,12H,1-5H3,(H,17,20)(H,18,19)
InChI Key:
RPUDBEPXPWGRGY-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(C(C(=O)O)(C)C)c1ccccc1
Properties
Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.163g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
293.363g/mol
Monoisotopic Mass:
293.163g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties