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Home Carboxys 1H-Indazole-3-carboxylic acid, 1-(phenylmethyl)-, methyl ester

1H-Indazole-3-carboxylic acid, 1-(phenylmethyl)-, methyl ester

CAS No.:
173600-03-8
Catalog Number:
AG00ARY3
Molecular Formula:
C16H14N2O2
Molecular Weight:
266.2946
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$299
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Product Description
Catalog Number:
AG00ARY3
Chemical Name:
1H-Indazole-3-carboxylic acid, 1-(phenylmethyl)-, methyl ester
CAS Number:
173600-03-8
Molecular Formula:
C16H14N2O2
Molecular Weight:
266.2946
MDL Number:
MFCD27964904
IUPAC Name:
methyl 1-benzylindazole-3-carboxylate
InChI:
InChI=1S/C16H14N2O2/c1-20-16(19)15-13-9-5-6-10-14(13)18(17-15)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3
InChI Key:
MDYQTFQMUAVGRX-UHFFFAOYSA-N
SMILES:
COC(=O)c1nn(c2c1cccc2)Cc1ccccc1
Properties
Complexity:
341  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.106g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.3g/mol
Monoisotopic Mass:
266.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties