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Home > Indoles and Oxindole > 33829-10-6
33829-10-6 | 2H-Indol-2-one, 1,3-dihydro-3-(1-naphthalenylimino)-
CAS No: 33829-10-6 Catalog No: AG007INM MDL No:
Product Description
Catalog Number:
AG007INM
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-3-(1-naphthalenylimino)-
CAS Number:
33829-10-6
Molecular Formula:
C18H12N2O
Molecular Weight:
272.3007
IUPAC Name:
3-naphthalen-1-ylimino-1H-indol-2-one
InChI:
InChI=1S/C18H12N2O/c21-18-17(14-9-3-4-10-16(14)20-18)19-15-11-5-7-12-6-1-2-8-13(12)15/h1-11H,(H,19,20,21)
InChI Key:
BHPDEUIEJALCLP-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1=Nc1cccc3c1cccc3)cccc2
Properties
Complexity:
445
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.095g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.307g/mol
Monoisotopic Mass:
272.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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