Home Aminos tert-butyl 3-(3-aminophenyl)propanoate

tert-butyl 3-(3-aminophenyl)propanoate

CAS No.:
269071-88-7
Catalog Number:
AG01BGDF
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
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Product Description
Catalog Number:
AG01BGDF
Chemical Name:
tert-butyl 3-(3-aminophenyl)propanoate
CAS Number:
269071-88-7
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
MDL Number:
MFCD23972938
IUPAC Name:
tert-butyl 3-(3-aminophenyl)propanoate
InChI:
InChI=1S/C13H19NO2/c1-13(2,3)16-12(15)8-7-10-5-4-6-11(14)9-10/h4-6,9H,7-8,14H2,1-3H3
InChI Key:
PAXUMWVHPFOIIP-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)CCc1cccc(c1)N
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.142g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.3g/mol
Monoisotopic Mass:
221.142g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties