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26000-55-5

26000-55-5 | 2H-Indol-2-one, 1,3-dihydro-3-(propylimino)-

CAS No: 26000-55-5 Catalog No: AG002RDE MDL No:

Product Description

Catalog Number:
AG002RDE
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-3-(propylimino)-
CAS Number:
26000-55-5
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
IUPAC Name:
3-propylimino-1H-indol-2-one
InChI:
InChI=1S/C11H12N2O/c1-2-7-12-10-8-5-3-4-6-9(8)13-11(10)14/h3-6H,2,7H2,1H3,(H,12,13,14)
InChI Key:
YRWRUTNAZBMBMU-UHFFFAOYSA-N
SMILES:
CCCN=C1C(=O)Nc2c1cccc2

Properties

Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.095g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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