Home Halogens 2-{5-bromo-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl}ethan-1-ol

2-{5-bromo-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl}ethan-1-ol

CAS No.:
1017048-94-0
Catalog Number:
AG019YYD
Molecular Formula:
C9H10BrN3O
Molecular Weight:
256.0992
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Product Description
Catalog Number:
AG019YYD
Chemical Name:
2-{5-bromo-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl}ethan-1-ol
CAS Number:
1017048-94-0
Molecular Formula:
C9H10BrN3O
Molecular Weight:
256.0992
MDL Number:
MFCD09944370
IUPAC Name:
2-(5-bromo-3-methylpyrazolo[3,4-b]pyridin-1-yl)ethanol
InChI:
InChI=1S/C9H10BrN3O/c1-6-8-4-7(10)5-11-9(8)13(12-6)2-3-14/h4-5,14H,2-3H2,1H3
InChI Key:
SVVUYMRGHUVUBD-UHFFFAOYSA-N
SMILES:
OCCn1nc(c2c1ncc(c2)Br)C
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.001g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.103g/mol
Monoisotopic Mass:
255.001g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties