Home Other Building Blocks 5-phenyl-4,5,6,7-tetrahydro-2H-indazol-3-ol

5-phenyl-4,5,6,7-tetrahydro-2H-indazol-3-ol

CAS No.:
1334148-99-0
Catalog Number:
AG01AJI8
Molecular Formula:
C13H14N2O
Molecular Weight:
214.2631
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Product Description
Catalog Number:
AG01AJI8
Chemical Name:
5-phenyl-4,5,6,7-tetrahydro-2H-indazol-3-ol
CAS Number:
1334148-99-0
Molecular Formula:
C13H14N2O
Molecular Weight:
214.2631
MDL Number:
MFCD19686254
IUPAC Name:
5-phenyl-1,2,4,5,6,7-hexahydroindazol-3-one
InChI:
InChI=1S/C13H14N2O/c16-13-11-8-10(6-7-12(11)14-15-13)9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,14,15,16)
InChI Key:
YICCKRIEQALKQJ-UHFFFAOYSA-N
SMILES:
Oc1[nH]nc2c1CC(CC2)c1ccccc1
Properties
Complexity:
329  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.111g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
214.268g/mol
Monoisotopic Mass:
214.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties