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142168-62-5

142168-62-5 | 3H-Indol-3-one, 5-methyl-2-(methylthio)-, oxime

CAS No: 142168-62-5 Catalog No: AG001HVD MDL No:

Product Description

Catalog Number:
AG001HVD
Chemical Name:
3H-Indol-3-one, 5-methyl-2-(methylthio)-, oxime
CAS Number:
142168-62-5
Molecular Formula:
C10H10N2OS
Molecular Weight:
206.2642
IUPAC Name:
5-methyl-2-methylsulfanyl-3-nitroso-1H-indole
InChI:
InChI=1S/C10H10N2OS/c1-6-3-4-8-7(5-6)9(12-13)10(11-8)14-2/h3-5,11H,1-2H3
InChI Key:
JNJVSIXEYDISTP-UHFFFAOYSA-N
SMILES:
ON=C1C(=Nc2c1cc(C)cc2)SC

Properties

Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.051g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.263g/mol
Monoisotopic Mass:
206.051g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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