Home Other Building Blocks 4-[(1H-1,2,3-triazol-1-yl)methyl]benzoic acid

4-[(1H-1,2,3-triazol-1-yl)methyl]benzoic acid

CAS No.:
118618-53-4
Catalog Number:
AG01BVHI
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01BVHI
Chemical Name:
4-[(1H-1,2,3-triazol-1-yl)methyl]benzoic acid
CAS Number:
118618-53-4
MDL Number:
MFCD20486501
IUPAC Name:
4-(triazol-1-ylmethyl)benzoic acid
InChI:
InChI=1S/C10H9N3O2/c14-10(15)9-3-1-8(2-4-9)7-13-6-5-11-12-13/h1-6H,7H2,(H,14,15)
InChI Key:
FRDJARYUYLORJD-UHFFFAOYSA-N
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.201g/mol
Monoisotopic Mass:
203.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties