Home Halogens 3-[(5-bromopyridin-2-yl)amino]butan-1-ol

3-[(5-bromopyridin-2-yl)amino]butan-1-ol

CAS No.:
1549576-41-1
Catalog Number:
AG01BB9Y
Molecular Formula:
C9H13BrN2O
Molecular Weight:
245.1163
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Product Description
Catalog Number:
AG01BB9Y
Chemical Name:
3-[(5-bromopyridin-2-yl)amino]butan-1-ol
CAS Number:
1549576-41-1
Molecular Formula:
C9H13BrN2O
Molecular Weight:
245.1163
MDL Number:
MFCD25980870
IUPAC Name:
3-[(5-bromopyridin-2-yl)amino]butan-1-ol
InChI:
InChI=1S/C9H13BrN2O/c1-7(4-5-13)12-9-3-2-8(10)6-11-9/h2-3,6-7,13H,4-5H2,1H3,(H,11,12)
InChI Key:
LQDUMIBCBURZOL-UHFFFAOYSA-N
SMILES:
OCCC(Nc1ccc(cn1)Br)C
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.021g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
245.12g/mol
Monoisotopic Mass:
244.021g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties