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Home Other Building Blocks 2-(Pyrazol-5-yl)phenol

2-(Pyrazol-5-yl)phenol

CAS No.:
34810-67-8
Catalog Number:
AG003F4D
Molecular Formula:
C9H8N2O
Molecular Weight:
160.1726
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$32
- +
5g
96%
In Stock USA
United States
$119
- +
25g
96%
In Stock USA
United States
$475
- +
Product Description
Catalog Number:
AG003F4D
Chemical Name:
2-(Pyrazol-5-yl)phenol
CAS Number:
34810-67-8
Molecular Formula:
C9H8N2O
Molecular Weight:
160.1726
MDL Number:
MFCD03093876
IUPAC Name:
2-(1H-pyrazol-5-yl)phenol
InChI:
InChI=1S/C9H8N2O/c12-9-4-2-1-3-7(9)8-5-6-10-11-8/h1-6,12H,(H,10,11)
InChI Key:
LKTJPAUDNOBJAZ-UHFFFAOYSA-N
SMILES:
Oc1ccccc1c1[nH]ncc1
EC Number:
252-222-4
Properties
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.064g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
160.176g/mol
Monoisotopic Mass:
160.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Highly efficient redox isomerisation of allylic alcohols catalysed by pyrazole-based ruthenium(IV) complexes in water: mechanisms of bifunctional catalysis in water. Chemistry (Weinheim an der Bergstrasse, Germany) 20120618
Synthesis and structure of ruthenium(IV) complexes featuring N-heterocyclic ligands with an N-H group as the hydrogen-bond donor: hydrogen interactions in solution and in the solid state. Inorganic chemistry 20110606
Self-assembly of high-nuclearity copper cages: tricorne Cu21 and saddlelike cyclic Cu16. Chemistry (Weinheim an der Bergstrasse, Germany) 20090101
Properties