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Home > Bromides > 1299312-97-2

1299312-97-2

1299312-97-2 | 3-Pyridinol, 5-bromo-6-methoxy-

CAS No: 1299312-97-2 Catalog No: AG000TS7 MDL No:

Product Description

Catalog Number:
AG000TS7
Chemical Name:
3-Pyridinol, 5-bromo-6-methoxy-
CAS Number:
1299312-97-2
Molecular Formula:
C6H6BrNO2
Molecular Weight:
204.0213
IUPAC Name:
5-bromo-6-methoxypyridin-3-ol
InChI:
InChI=1S/C6H6BrNO2/c1-10-6-5(7)2-4(9)3-8-6/h2-3,9H,1H3
InChI Key:
GPLHBPPGBOMBRH-UHFFFAOYSA-N
SMILES:
COc1ncc(cc1Br)O

Properties

Complexity:
112  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.958g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.023g/mol
Monoisotopic Mass:
202.958g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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