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88482-24-0 | 5H-Inden-5-one, 1,6,7,7a-tetrahydro-1-hydroxy-7a-methyl-
CAS No: 88482-24-0 Catalog No: AG0049I4 MDL No:
Product Description
Catalog Number:
AG0049I4
Chemical Name:
5H-Inden-5-one, 1,6,7,7a-tetrahydro-1-hydroxy-7a-methyl-
CAS Number:
88482-24-0
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
IUPAC Name:
1-hydroxy-7a-methyl-6,7-dihydro-1H-inden-5-one
InChI:
InChI=1S/C10H12O2/c1-10-5-4-8(11)6-7(10)2-3-9(10)12/h2-3,6,9,12H,4-5H2,1H3
InChI Key:
HTSHVQFXOQRAQC-UHFFFAOYSA-N
SMILES:
O=C1CCC2(C(=C1)C=CC2O)C
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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