Home Carboxys 1H-Indene-1-carboxylic acid, 2,3-dihydro-3-oxo-, methyl ester

1H-Indene-1-carboxylic acid, 2,3-dihydro-3-oxo-, methyl ester

CAS No.:
29427-70-1
Catalog Number:
AG002YCX
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
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Product Description
Catalog Number:
AG002YCX
Chemical Name:
1H-Indene-1-carboxylic acid, 2,3-dihydro-3-oxo-, methyl ester
CAS Number:
29427-70-1
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
MDL Number:
MFCD01846161
IUPAC Name:
methyl 3-oxo-1,2-dihydroindene-1-carboxylate
InChI:
InChI=1S/C11H10O3/c1-14-11(13)9-6-10(12)8-5-3-2-4-7(8)9/h2-5,9H,6H2,1H3
InChI Key:
HFFSDUMJDBSQKA-UHFFFAOYSA-N
SMILES:
COC(=O)C1CC(=O)c2c1cccc2
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.063g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.198g/mol
Monoisotopic Mass:
190.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties