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50800-92-5 | 2-(4-Methoxyphenoxy)ethanamine
CAS No: 50800-92-5 Catalog No: AG003EWR MDL No:MFCD00052978
Product Description
Catalog Number:
AG003EWR
Chemical Name:
2-(4-Methoxyphenoxy)ethanamine
CAS Number:
50800-92-5
Molecular Formula:
C9H13NO2
Molecular Weight:
167.2050
MDL Number:
MFCD00052978
IUPAC Name:
2-(4-methoxyphenoxy)ethanamine
InChI:
InChI=1S/C9H13NO2/c1-11-8-2-4-9(5-3-8)12-7-6-10/h2-5H,6-7,10H2,1H3
InChI Key:
YXRCDWIZAGWUBL-UHFFFAOYSA-N
SMILES:
NCCOc1ccc(cc1)OC
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.208g/mol
Monoisotopic Mass:
167.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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