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70080-52-3 | 6-[Hydroxy[2-(2-hydroxyethenyl)-1H-inden-1-ylidene]methyl]-2(1H)-pyridinone
CAS No: 70080-52-3 Catalog No: AG00FSSB MDL No:
Product Description
Catalog Number:
AG00FSSB
Chemical Name:
6-[Hydroxy[2-(2-hydroxyethenyl)-1H-inden-1-ylidene]methyl]-2(1H)-pyridinone
CAS Number:
70080-52-3
IUPAC Name:
6-[hydroxy-[2-(2-hydroxyethenyl)inden-1-ylidene]methyl]-1H-pyridin-2-one
InChI:
InChI=1S/C17H13NO3/c19-9-8-12-10-11-4-1-2-5-13(11)16(12)17(21)14-6-3-7-15(20)18-14/h1-10,19,21H,(H,18,20)
InChI Key:
ZZBQYBDRLBNPJL-UHFFFAOYSA-N
Properties
Complexity:
608
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.09g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
279.295g/mol
Monoisotopic Mass:
279.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
1.7
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