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101084-20-2

101084-20-2 | 4-Pyridinol, 3-amino-5-bromo-

CAS No: 101084-20-2 Catalog No: AG0003PG MDL No:MFCD08692340

Product Description

Catalog Number:
AG0003PG
Chemical Name:
4-Pyridinol, 3-amino-5-bromo-
CAS Number:
101084-20-2
Molecular Formula:
C5H5BrN2O
Molecular Weight:
189.0100
MDL Number:
MFCD08692340
IUPAC Name:
3-amino-5-bromo-1H-pyridin-4-one
InChI:
InChI=1S/C5H5BrN2O/c6-3-1-8-2-4(7)5(3)9/h1-2H,7H2,(H,8,9)
InChI Key:
DMZVRJHJGBNINH-UHFFFAOYSA-N
SMILES:
Oc1c(N)cncc1Br

Properties

Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.959g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
189.012g/mol
Monoisotopic Mass:
187.959g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

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