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58897-60-2

58897-60-2 | 6-(4-ISOPROPYLPHENYL)-3(2H)-PYRIDAZINONE

CAS No: 58897-60-2 Catalog No: AG00EZA3 MDL No:

Product Description

Catalog Number:
AG00EZA3
Chemical Name:
6-(4-ISOPROPYLPHENYL)-3(2H)-PYRIDAZINONE
CAS Number:
58897-60-2
IUPAC Name:
3-(4-propan-2-ylphenyl)-1H-pyridazin-6-one
InChI:
InChI=1S/C13H14N2O/c1-9(2)10-3-5-11(6-4-10)12-7-8-13(16)15-14-12/h3-9H,1-2H3,(H,15,16)
InChI Key:
KDRHOGIZKXNGET-UHFFFAOYSA-N

Properties

Complexity:
323  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
214.268g/mol
Monoisotopic Mass:
214.111g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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