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124067-30-7 | 2H-Inden-2-one, 1,3-dihydro-4-methoxy-
CAS No: 124067-30-7 Catalog No: AG000LJ0 MDL No:MFCD09744098
Product Description
Catalog Number:
AG000LJ0
Chemical Name:
2H-Inden-2-one, 1,3-dihydro-4-methoxy-
CAS Number:
124067-30-7
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
MDL Number:
MFCD09744098
IUPAC Name:
4-methoxy-1,3-dihydroinden-2-one
InChI:
InChI=1S/C10H10O2/c1-12-10-4-2-3-7-5-8(11)6-9(7)10/h2-4H,5-6H2,1H3
InChI Key:
JBDVYNOISPHDQI-UHFFFAOYSA-N
SMILES:
COc1cccc2c1CC(=O)C2
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.188g/mol
Monoisotopic Mass:
162.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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