Home Carbonyls 4-(1-((tert-Butoxycarbonyl)amino)ethyl)benzoic acid

4-(1-((tert-Butoxycarbonyl)amino)ethyl)benzoic acid

CAS No.:
895577-21-6
Catalog Number:
AG00IFRI
Molecular Formula:
C14H19NO4
Molecular Weight:
265.3050
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Product Description
Catalog Number:
AG00IFRI
Chemical Name:
4-(1-((tert-Butoxycarbonyl)amino)ethyl)benzoic acid
CAS Number:
895577-21-6
Molecular Formula:
C14H19NO4
Molecular Weight:
265.3050
MDL Number:
MFCD11505982
IUPAC Name:
4-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]benzoic acid
InChI:
InChI=1S/C14H19NO4/c1-9(15-13(18)19-14(2,3)4)10-5-7-11(8-6-10)12(16)17/h5-9H,1-4H3,(H,15,18)(H,16,17)
InChI Key:
OKRPFRUXMOYTDV-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)C(=O)O)NC(=O)OC(C)(C)C
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.131g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
265.309g/mol
Monoisotopic Mass:
265.131g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties