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Home Carboxys 1-benzyl-1H-pyrazolo[3,4-b]pyridine-3-carboxylic acid

1-benzyl-1H-pyrazolo[3,4-b]pyridine-3-carboxylic acid

CAS No.:
1185287-60-8
Catalog Number:
AG00J39K
Molecular Formula:
C14H11N3O2
Molecular Weight:
253.2560
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
5g
95%
In Stock USA
United States
$1136
- +
Product Description
Catalog Number:
AG00J39K
Chemical Name:
1-benzyl-1H-pyrazolo[3,4-b]pyridine-3-carboxylic acid
CAS Number:
1185287-60-8
Molecular Formula:
C14H11N3O2
Molecular Weight:
253.2560
MDL Number:
MFCD22107914
IUPAC Name:
1-benzylpyrazolo[3,4-b]pyridine-3-carboxylic acid
InChI:
InChI=1S/C14H11N3O2/c18-14(19)12-11-7-4-8-15-13(11)17(16-12)9-10-5-2-1-3-6-10/h1-8H,9H2,(H,18,19)
InChI Key:
QLDNIXIDTPFIOV-UHFFFAOYSA-N
SMILES:
OC(=O)c1nn(c2c1cccn2)Cc1ccccc1
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.085g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.261g/mol
Monoisotopic Mass:
253.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties