Home Carboxys Benzyl 1-benzyl-1h-indazole-3-carboxylate

Benzyl 1-benzyl-1h-indazole-3-carboxylate

CAS No.:
174180-54-2
Catalog Number:
AG001ZHK
Molecular Formula:
C22H18N2O2
Molecular Weight:
342.3905
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>97%
In Stock USA
United States
$151
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Product Description
Catalog Number:
AG001ZHK
Chemical Name:
Benzyl 1-benzyl-1h-indazole-3-carboxylate
CAS Number:
174180-54-2
Molecular Formula:
C22H18N2O2
Molecular Weight:
342.3905
MDL Number:
MFCD20134219
IUPAC Name:
benzyl 1-benzylindazole-3-carboxylate
InChI:
InChI=1S/C22H18N2O2/c25-22(26-16-18-11-5-2-6-12-18)21-19-13-7-8-14-20(19)24(23-21)15-17-9-3-1-4-10-17/h1-14H,15-16H2
InChI Key:
PBFSDBVIGNCTEE-UHFFFAOYSA-N
SMILES:
O=C(c1nn(c2c1cccc2)Cc1ccccc1)OCc1ccccc1
Properties
Complexity:
457  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.137g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.398g/mol
Monoisotopic Mass:
342.137g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  
Properties