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26646-35-5 | 2-(3-Nitrophenoxy);ethanamine
CAS No: 26646-35-5 Catalog No: AG003EU7 MDL No:MFCD12824702
Product Description
Catalog Number:
AG003EU7
Chemical Name:
2-(3-Nitrophenoxy);ethanamine
CAS Number:
26646-35-5
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
MDL Number:
MFCD12824702
IUPAC Name:
2-(3-nitrophenoxy)ethanamine
InChI:
InChI=1S/C8H10N2O3/c9-4-5-13-8-3-1-2-7(6-8)10(11)12/h1-3,6H,4-5,9H2
InChI Key:
HJGILQJJFYDIRR-UHFFFAOYSA-N
SMILES:
NCCOc1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
169
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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