Home Carboxys 1-(4-Methoxy-benzyl)-1H-[1,2,3]triazole-4-carboxylic acid

1-(4-Methoxy-benzyl)-1H-[1,2,3]triazole-4-carboxylic acid

CAS No.:
4916-13-6
Catalog Number:
AG00DBTK
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DBTK
Chemical Name:
1-(4-Methoxy-benzyl)-1H-[1,2,3]triazole-4-carboxylic acid
CAS Number:
4916-13-6
MDL Number:
MFCD08445773
IUPAC Name:
1-[(4-methoxyphenyl)methyl]triazole-4-carboxylic acid
InChI:
InChI=1S/C11H11N3O3/c1-17-9-4-2-8(3-5-9)6-14-7-10(11(15)16)12-13-14/h2-5,7H,6H2,1H3,(H,15,16)
InChI Key:
WOVCZGZVFJWZBD-UHFFFAOYSA-N
Properties
Complexity:
267  
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:
4  
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties