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Home Carboxys 1-(2-Methoxyphenyl)-5-methyl-1h-1,2,3-triazole-4-carboxylic acid

1-(2-Methoxyphenyl)-5-methyl-1h-1,2,3-triazole-4-carboxylic acid

CAS No.:
210159-13-0
Catalog Number:
AG00BDMH
Molecular Formula:
C11H11N3O3
Molecular Weight:
233.2233
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$113
- +
500mg
95%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG00BDMH
Chemical Name:
1-(2-Methoxyphenyl)-5-methyl-1h-1,2,3-triazole-4-carboxylic acid
CAS Number:
210159-13-0
Molecular Formula:
C11H11N3O3
Molecular Weight:
233.2233
MDL Number:
MFCD07397771
IUPAC Name:
1-(2-methoxyphenyl)-5-methyltriazole-4-carboxylic acid
InChI:
InChI=1S/C11H11N3O3/c1-7-10(11(15)16)12-13-14(7)8-5-3-4-6-9(8)17-2/h3-6H,1-2H3,(H,15,16)
InChI Key:
XDIJXIDIHIYINO-UHFFFAOYSA-N
SMILES:
COc1ccccc1n1nnc(c1C)C(=O)O
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.08g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.227g/mol
Monoisotopic Mass:
233.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties