Home Other Building Blocks 2-(2-phenyl-2H-1,2,3-triazol-4-yl)acetic acid

2-(2-phenyl-2H-1,2,3-triazol-4-yl)acetic acid

CAS No.:
64404-13-3
Catalog Number:
AG019UTJ
Molecular Formula:
C10H9N3O2
Molecular Weight:
203.1974
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Product Description
Catalog Number:
AG019UTJ
Chemical Name:
2-(2-phenyl-2H-1,2,3-triazol-4-yl)acetic acid
CAS Number:
64404-13-3
Molecular Formula:
C10H9N3O2
Molecular Weight:
203.1974
MDL Number:
MFCD11857954
IUPAC Name:
2-(2-phenyltriazol-4-yl)acetic acid
InChI:
InChI=1S/C10H9N3O2/c14-10(15)6-8-7-11-13(12-8)9-4-2-1-3-5-9/h1-5,7H,6H2,(H,14,15)
InChI Key:
ZCYGMFCBXFGAKO-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cnn(n1)c1ccccc1
Properties
Complexity:
229  
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:
1.4  
Properties