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60814-16-6 | 2-(4-Nitrophenoxy);ethanamine
CAS No: 60814-16-6 Catalog No: AG003EXC MDL No:MFCD00634284
Product Description
Catalog Number:
AG003EXC
Chemical Name:
2-(4-Nitrophenoxy);ethanamine
CAS Number:
60814-16-6
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
MDL Number:
MFCD00634284
IUPAC Name:
2-(4-nitrophenoxy)ethanamine
InChI:
InChI=1S/C8H10N2O3/c9-5-6-13-8-3-1-7(2-4-8)10(11)12/h1-4H,5-6,9H2
InChI Key:
HIEVUCALPWFEFA-UHFFFAOYSA-N
SMILES:
NCCOc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.179g/mol
Monoisotopic Mass:
182.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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