Home Other Building Blocks sodium 3-(4-ethylphenyl)-3-oxoprop-1-en-1-olate

sodium 3-(4-ethylphenyl)-3-oxoprop-1-en-1-olate

CAS No.:
1258828-09-9
Catalog Number:
AG01AAJT
Molecular Formula:
C11H11NaO2
Molecular Weight:
198.1936
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Product Description
Catalog Number:
AG01AAJT
Chemical Name:
sodium 3-(4-ethylphenyl)-3-oxoprop-1-en-1-olate
CAS Number:
1258828-09-9
Molecular Formula:
C11H11NaO2
Molecular Weight:
198.1936
MDL Number:
MFCD17167209
IUPAC Name:
sodium;3-(4-ethylphenyl)-3-oxoprop-1-en-1-olate
InChI:
InChI=1S/C11H12O2.Na/c1-2-9-3-5-10(6-4-9)11(13)7-8-12;/h3-8,12H,2H2,1H3;/q;+1/p-1
InChI Key:
IHGSSKHCSNLMCG-UHFFFAOYSA-M
SMILES:
CCc1ccc(cc1)C(=O)C=C[O-].[Na+]
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.066g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.197g/mol
Monoisotopic Mass:
198.066g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
Properties