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1273609-29-2 | 1H-Inden-1-one, 7-ethoxy-2,3-dihydro-
CAS No: 1273609-29-2 Catalog No: AG000WZ7 MDL No:
Product Description
Catalog Number:
AG000WZ7
Chemical Name:
1H-Inden-1-one, 7-ethoxy-2,3-dihydro-
CAS Number:
1273609-29-2
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
IUPAC Name:
7-ethoxy-2,3-dihydroinden-1-one
InChI:
InChI=1S/C11H12O2/c1-2-13-10-5-3-4-8-6-7-9(12)11(8)10/h3-5H,2,6-7H2,1H3
InChI Key:
XLEGTAXAENNGBZ-UHFFFAOYSA-N
SMILES:
CCOc1cccc2c1C(=O)CC2
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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