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59868-43-8

59868-43-8 | 6-(methylsulfanyl)-2,3-dihydro-1H-indole-2,3-dione

CAS No: 59868-43-8 Catalog No: AG019T0O MDL No:MFCD12823704

Product Description

Catalog Number:
AG019T0O
Chemical Name:
6-(methylsulfanyl)-2,3-dihydro-1H-indole-2,3-dione
CAS Number:
59868-43-8
Molecular Formula:
C9H7NO2S
Molecular Weight:
193.2224
MDL Number:
MFCD12823704
IUPAC Name:
6-methylsulfanyl-1H-indole-2,3-dione
InChI:
InChI=1S/C9H7NO2S/c1-13-5-2-3-6-7(4-5)10-9(12)8(6)11/h2-4H,1H3,(H,10,11,12)
InChI Key:
XCKPLMWRTAIYBU-UHFFFAOYSA-N
SMILES:
CSc1ccc2c(c1)NC(=O)C2=O

Properties

Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.02g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.22g/mol
Monoisotopic Mass:
193.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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