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Home Other Building Blocks 1-Tosyl-1H-Indazole-5-Carboxylic Acid

1-Tosyl-1H-Indazole-5-Carboxylic Acid

CAS No.:
2007917-31-7
Catalog Number:
AG01DJU1
Molecular Formula:
C15H12N2O4S
Molecular Weight:
316.3318
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$168
- +
250mg
95%
In Stock USA
United States
$294
- +
1g
95%
In Stock USA
United States
$588
- +
Product Description
Catalog Number:
AG01DJU1
Chemical Name:
1-Tosyl-1H-Indazole-5-Carboxylic Acid
CAS Number:
2007917-31-7
Molecular Formula:
C15H12N2O4S
Molecular Weight:
316.3318
MDL Number:
MFCD30471910
IUPAC Name:
1-(4-methylphenyl)sulfonylindazole-5-carboxylic acid
InChI:
InChI=1S/C15H12N2O4S/c1-10-2-5-13(6-3-10)22(20,21)17-14-7-4-11(15(18)19)8-12(14)9-16-17/h2-9H,1H3,(H,18,19)
InChI Key:
NHAKGXMFSVHJSB-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)n1ncc2c1ccc(c2)C(=O)O
Properties
Complexity:
522  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.052g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
316.331g/mol
Monoisotopic Mass:
316.052g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties