Home Carbonyls 2-{[(tert-butoxy)carbonyl]amino}-3-(3-phenoxyphenyl)propanoic acid

2-{[(tert-butoxy)carbonyl]amino}-3-(3-phenoxyphenyl)propanoic acid

CAS No.:
119349-24-5
Catalog Number:
AG01EKIM
Molecular Formula:
C20H23NO5
Molecular Weight:
357.4003
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Product Description
Catalog Number:
AG01EKIM
Chemical Name:
2-{[(tert-butoxy)carbonyl]amino}-3-(3-phenoxyphenyl)propanoic acid
CAS Number:
119349-24-5
Molecular Formula:
C20H23NO5
Molecular Weight:
357.4003
MDL Number:
MFCD31689493
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-phenoxyphenyl)propanoic acid
InChI:
InChI=1S/C20H23NO5/c1-20(2,3)26-19(24)21-17(18(22)23)13-14-8-7-11-16(12-14)25-15-9-5-4-6-10-15/h4-12,17H,13H2,1-3H3,(H,21,24)(H,22,23)
InChI Key:
FNVJDYQQJDPXDX-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(C(=O)O)Cc1cccc(c1)Oc1ccccc1
Properties
Complexity:
467  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.158g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
357.406g/mol
Monoisotopic Mass:
357.158g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties