Home Carboxys sodium 2-oxo-2,3-dihydro-1H-indole-6-carboxylate

sodium 2-oxo-2,3-dihydro-1H-indole-6-carboxylate

CAS No.:
1955506-95-2
Catalog Number:
AG01C3IP
Molecular Formula:
C9H6NNaO3
Molecular Weight:
199.1386
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Product Description
Catalog Number:
AG01C3IP
Chemical Name:
sodium 2-oxo-2,3-dihydro-1H-indole-6-carboxylate
CAS Number:
1955506-95-2
Molecular Formula:
C9H6NNaO3
Molecular Weight:
199.1386
MDL Number:
MFCD29060474
IUPAC Name:
sodium;2-oxo-1,3-dihydroindole-6-carboxylate
InChI:
InChI=1S/C9H7NO3.Na/c11-8-4-5-1-2-6(9(12)13)3-7(5)10-8;/h1-3H,4H2,(H,10,11)(H,12,13);/q;+1/p-1
InChI Key:
ORSACVLEJRAALP-UHFFFAOYSA-M
SMILES:
O=C1Cc2c(N1)cc(cc2)C(=O)[O-].[Na+]
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.025g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.141g/mol
Monoisotopic Mass:
199.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties