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929339-41-3

929339-41-3 | 2-[(1-ethyl-1H-indol-3-yl)methylidene]-6-hydroxy-7-methyl-2,3-dihydro-1-benzofuran-3-one

CAS No: 929339-41-3 Catalog No: AG019MJ3 MDL No:MFCD09259082

Product Description

Catalog Number:
AG019MJ3
Chemical Name:
2-[(1-ethyl-1H-indol-3-yl)methylidene]-6-hydroxy-7-methyl-2,3-dihydro-1-benzofuran-3-one
CAS Number:
929339-41-3
Molecular Formula:
C20H17NO3
Molecular Weight:
319.3539
MDL Number:
MFCD09259082
IUPAC Name:
2-[(1-ethylindol-3-yl)methylidene]-6-hydroxy-7-methyl-1-benzofuran-3-one
InChI:
InChI=1S/C20H17NO3/c1-3-21-11-13(14-6-4-5-7-16(14)21)10-18-19(23)15-8-9-17(22)12(2)20(15)24-18/h4-11,22H,3H2,1-2H3
InChI Key:
BTBLYQKTCPHXIJ-UHFFFAOYSA-N
SMILES:
CCn1cc(c2c1cccc2)C=C1Oc2c(C1=O)ccc(c2C)O

Properties

Complexity:
531  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.121g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
319.36g/mol
Monoisotopic Mass:
319.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
4  

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