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84308-29-2 | Cyclohexanone, 3-(2-oxopropyl)-, (3R)-
CAS No: 84308-29-2 Catalog No: AG004T98 MDL No:
Product Description
Catalog Number:
AG004T98
Chemical Name:
Cyclohexanone, 3-(2-oxopropyl)-, (3R)-
CAS Number:
84308-29-2
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
IUPAC Name:
(3R)-3-(2-oxopropyl)cyclohexan-1-one
InChI:
InChI=1S/C9H14O2/c1-7(10)5-8-3-2-4-9(11)6-8/h8H,2-6H2,1H3/t8-/m1/s1
InChI Key:
RJMIBGCTYAZHJV-MRVPVSSYSA-N
SMILES:
CC(=O)C[C@H]1CCCC(=O)C1
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
154.099g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.209g/mol
Monoisotopic Mass:
154.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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