CID 600093
Chemical Structure Depiction
2,3,4,5,6,7-hexahydro-1H-indene-1,2,3,3a,7a-pentaide
InChI=1S/C9H11/c1-2-5-9-7-3-6-8(9)4-1/h3,6-7H,1-2,4-5H2/q-5
ISUCSXWCRRCRJY-UHFFFAOYSA-N
C1CC[C-]2[CH-][CH-][CH-][C-]2C1
C9H11-5
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
119.18 g/mol
Property Name
XLogP3-AA
Property Value
4.1
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
5
Property Name
Rotatable Bond Count
Property Value
0
Property Name
Exact Mass
Property Value
119.086075351 g/mol
Property Name
Monoisotopic Mass
Property Value
119.086075351 g/mol
Property Name
Topological Polar Surface Area
Property Value
0 A^2
Property Name
Heavy Atom Count
Property Value
9
Property Name
Formal Charge
Property Value
-5
Property Name
Complexity
Property Value
84.2
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
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CONTENTS