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Home > Pyridines > 1421944-09-3
1421944-09-3 | 2-methyl-6-[(E)-2-phenylethenyl]-2,3,4,5-tetrahydropyridazin-3-one
CAS No: 1421944-09-3 Catalog No: AG00IOQO MDL No:MFCD00793234
Product Description
Catalog Number:
AG00IOQO
Chemical Name:
2-methyl-6-[(E)-2-phenylethenyl]-2,3,4,5-tetrahydropyridazin-3-one
CAS Number:
1421944-09-3
Molecular Formula:
C13H14N2O
Molecular Weight:
214.2631
MDL Number:
MFCD00793234
IUPAC Name:
2-methyl-6-(2-phenylethenyl)-4,5-dihydropyridazin-3-one
InChI:
InChI=1S/C13H14N2O/c1-15-13(16)10-9-12(14-15)8-7-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3
InChI Key:
ALNKXYSIOOSXLW-UHFFFAOYSA-N
SMILES:
CN1N=C(CCC1=O)/C=C/c1ccccc1
Properties
Complexity:
314
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:
0
Isotope Atom Count:
0
Molecular Weight:
214.268g/mol
Monoisotopic Mass:
214.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.5
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