Home Carboxys 1-(4-fluoro-2-methylphenyl)-1H-1,2,3-triazole-4-carboxylic acid

1-(4-fluoro-2-methylphenyl)-1H-1,2,3-triazole-4-carboxylic acid

CAS No.:
1042604-81-8
Catalog Number:
AG01A3TX
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01A3TX
Chemical Name:
1-(4-fluoro-2-methylphenyl)-1H-1,2,3-triazole-4-carboxylic acid
CAS Number:
1042604-81-8
MDL Number:
MFCD11168167
IUPAC Name:
1-(4-fluoro-2-methylphenyl)triazole-4-carboxylic acid
InChI:
InChI=1S/C10H8FN3O2/c1-6-4-7(11)2-3-9(6)14-5-8(10(15)16)12-13-14/h2-5H,1H3,(H,15,16)
InChI Key:
VLTACRKNEWKDEZ-UHFFFAOYSA-N
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.06g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.191g/mol
Monoisotopic Mass:
221.06g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties