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Home > Pyridines > 303146-59-0
303146-59-0 | 6-[(E)-2-[4-(propan-2-yl)phenyl]ethenyl]-2,3,4,5-tetrahydropyridazin-3-one
CAS No: 303146-59-0 Catalog No: AG00IUSF MDL No:MFCD00793320
Product Description
Catalog Number:
AG00IUSF
Chemical Name:
6-[(E)-2-[4-(propan-2-yl)phenyl]ethenyl]-2,3,4,5-tetrahydropyridazin-3-one
CAS Number:
303146-59-0
Molecular Formula:
C15H18N2O
Molecular Weight:
242.3162
MDL Number:
MFCD00793320
IUPAC Name:
3-[2-(4-propan-2-ylphenyl)ethenyl]-4,5-dihydro-1H-pyridazin-6-one
InChI:
InChI=1S/C15H18N2O/c1-11(2)13-6-3-12(4-7-13)5-8-14-9-10-15(18)17-16-14/h3-8,11H,9-10H2,1-2H3,(H,17,18)
InChI Key:
WXUVHMUASUDVKR-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)/C=C/C1=NNC(=O)CC1)C
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.142g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.322g/mol
Monoisotopic Mass:
242.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.5
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