Home Other Building Blocks Phenol, 3-(2H-1,2,3-triazol-2-yl)-

Phenol, 3-(2H-1,2,3-triazol-2-yl)-

CAS No.:
67149-24-0
Catalog Number:
AG01DTEJ
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
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Product Description
Catalog Number:
AG01DTEJ
Chemical Name:
Phenol, 3-(2H-1,2,3-triazol-2-yl)-
CAS Number:
67149-24-0
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
MDL Number:
MFCD28516640
IUPAC Name:
3-(triazol-2-yl)phenol
InChI:
InChI=1S/C8H7N3O/c12-8-3-1-2-7(6-8)11-9-4-5-10-11/h1-6,12H
InChI Key:
QUHZINPGQOQTQI-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)n1nccn1
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
161.164g/mol
Monoisotopic Mass:
161.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties