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Home Carboxys tert-Butyl 3-formyl-1H-pyrazolo[3,4-b]pyridine-1-carboxylate

tert-Butyl 3-formyl-1H-pyrazolo[3,4-b]pyridine-1-carboxylate

CAS No.:
1155846-83-5
Catalog Number:
AG00J2BW
Molecular Formula:
C12H13N3O3
Molecular Weight:
247.2499
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
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Product Description
Catalog Number:
AG00J2BW
Chemical Name:
tert-Butyl 3-formyl-1H-pyrazolo[3,4-b]pyridine-1-carboxylate
CAS Number:
1155846-83-5
Molecular Formula:
C12H13N3O3
Molecular Weight:
247.2499
MDL Number:
MFCD22394871
IUPAC Name:
tert-butyl 3-formylpyrazolo[3,4-b]pyridine-1-carboxylate
InChI:
InChI=1S/C12H13N3O3/c1-12(2,3)18-11(17)15-10-8(5-4-6-13-10)9(7-16)14-15/h4-7H,1-3H3
InChI Key:
XKYBGNYQLOMUML-UHFFFAOYSA-N
SMILES:
O=Cc1nn(c2c1cccn2)C(=O)OC(C)(C)C
Properties
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.096g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.254g/mol
Monoisotopic Mass:
247.096g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties