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117011-70-8 | Propanoic acid, 2-(4-aminophenoxy)-2-methyl-
CAS No: 117011-70-8 Catalog No: AG000DJT MDL No:MFCD00084883
Product Description
Catalog Number:
AG000DJT
Chemical Name:
Propanoic acid, 2-(4-aminophenoxy)-2-methyl-
CAS Number:
117011-70-8
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD00084883
IUPAC Name:
2-(4-aminophenoxy)-2-methylpropanoic acid
InChI:
InChI=1S/C10H13NO3/c1-10(2,9(12)13)14-8-5-3-7(11)4-6-8/h3-6H,11H2,1-2H3,(H,12,13)
InChI Key:
JTARICLTMYASES-UHFFFAOYSA-N
SMILES:
OC(=O)C(Oc1ccc(cc1)N)(C)C
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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