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Home > Bromides > 1171897-14-5
1171897-14-5 | Propanamide, N-(5-bromo-3-pyridinyl)-
CAS No: 1171897-14-5 Catalog No: AG000DWC MDL No:MFCD17169875
Product Description
Catalog Number:
AG000DWC
Chemical Name:
Propanamide, N-(5-bromo-3-pyridinyl)-
CAS Number:
1171897-14-5
Molecular Formula:
C8H9BrN2O
Molecular Weight:
229.0739
MDL Number:
MFCD17169875
IUPAC Name:
N-(5-bromopyridin-3-yl)propanamide
InChI:
InChI=1S/C8H9BrN2O/c1-2-8(12)11-7-3-6(9)4-10-5-7/h3-5H,2H2,1H3,(H,11,12)
InChI Key:
LCVFJAPOTXJYHG-UHFFFAOYSA-N
SMILES:
CCC(=O)Nc1cncc(c1)Br
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.99g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.077g/mol
Monoisotopic Mass:
227.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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