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88634-12-2

88634-12-2 | 1,3-Cyclohexanedione, 5-(2,3-dihydro-5,6,7-trimethyl-1H-inden-4-yl)-

CAS No: 88634-12-2 Catalog No: AG004A73 MDL No:

Product Description

Catalog Number:
AG004A73
Chemical Name:
1,3-Cyclohexanedione, 5-(2,3-dihydro-5,6,7-trimethyl-1H-inden-4-yl)-
CAS Number:
88634-12-2
Molecular Formula:
C18H22O2
Molecular Weight:
270.3661
IUPAC Name:
5-(5,6,7-trimethyl-2,3-dihydro-1H-inden-4-yl)cyclohexane-1,3-dione
InChI:
InChI=1S/C18H22O2/c1-10-11(2)16-5-4-6-17(16)18(12(10)3)13-7-14(19)9-15(20)8-13/h13H,4-9H2,1-3H3
InChI Key:
DNIIJUQGSVAOQU-UHFFFAOYSA-N
SMILES:
O=C1CC(=O)CC(C1)c1c(C)c(C)c(c2c1CCC2)C

Properties

Complexity:
398  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.162g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.372g/mol
Monoisotopic Mass:
270.162g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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