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29450-02-0 | Ethanamine, 2-[(5-bromo-2-pyridinyl)oxy]-
CAS No: 29450-02-0 Catalog No: AG002YFE MDL No:MFCD13190741
Product Description
Catalog Number:
AG002YFE
Chemical Name:
Ethanamine, 2-[(5-bromo-2-pyridinyl)oxy]-
CAS Number:
29450-02-0
Molecular Formula:
C7H9BrN2O
Molecular Weight:
217.0632
MDL Number:
MFCD13190741
IUPAC Name:
2-(5-bromopyridin-2-yl)oxyethanamine
InChI:
InChI=1S/C7H9BrN2O/c8-6-1-2-7(10-5-6)11-4-3-9/h1-2,5H,3-4,9H2
InChI Key:
NVZKOKAVBWRZPJ-UHFFFAOYSA-N
SMILES:
NCCOc1ccc(cn1)Br
Properties
Complexity:
113
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.99g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.066g/mol
Monoisotopic Mass:
215.99g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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