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56208-37-8 | Disperse Yellow 39 surrogate
CAS No: 56208-37-8 Catalog No: AG01FNZ4 MDL No:
Product Description
Catalog Number:
AG01FNZ4
Chemical Name:
Disperse Yellow 39 surrogate
CAS Number:
56208-37-8
IUPAC Name:
3-(1-ethyl-2-hydroxyindol-3-yl)isoindol-1-one
InChI:
InChI=1S/C18H14N2O2/c1-2-20-14-10-6-5-9-13(14)15(18(20)22)16-11-7-3-4-8-12(11)17(21)19-16/h3-10,22H,2H2,1H3
InChI Key:
KGZGXZIQLRICLZ-UHFFFAOYSA-N
Properties
Complexity:
490
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.106g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.322g/mol
Monoisotopic Mass:
290.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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