Home Carbonyls 2-{[(tert-butoxy)carbonyl]amino}-2-(4-ethoxyphenyl)acetic acid

2-{[(tert-butoxy)carbonyl]amino}-2-(4-ethoxyphenyl)acetic acid

CAS No.:
1404877-92-4
Catalog Number:
AG01EKF8
Molecular Formula:
C15H21NO5
Molecular Weight:
295.3309
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Product Description
Catalog Number:
AG01EKF8
Chemical Name:
2-{[(tert-butoxy)carbonyl]amino}-2-(4-ethoxyphenyl)acetic acid
CAS Number:
1404877-92-4
Molecular Formula:
C15H21NO5
Molecular Weight:
295.3309
MDL Number:
MFCD07388835
IUPAC Name:
2-(4-ethoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
InChI:
InChI=1S/C15H21NO5/c1-5-20-11-8-6-10(7-9-11)12(13(17)18)16-14(19)21-15(2,3)4/h6-9,12H,5H2,1-4H3,(H,16,19)(H,17,18)
InChI Key:
BEDGGMAQIUFUCP-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)C(C(=O)O)NC(=O)OC(C)(C)C
Properties
Complexity:
356  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.142g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
295.335g/mol
Monoisotopic Mass:
295.142g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties