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14749-52-1 | Cyclohexanone, 2,2'-ethylidenebis-
CAS No: 14749-52-1 Catalog No: AG001EXA MDL No:
Product Description
Catalog Number:
AG001EXA
Chemical Name:
Cyclohexanone, 2,2'-ethylidenebis-
CAS Number:
14749-52-1
Molecular Formula:
C14H22O2
Molecular Weight:
222.3233
IUPAC Name:
2-[1-(2-oxocyclohexyl)ethyl]cyclohexan-1-one
InChI:
InChI=1S/C14H22O2/c1-10(11-6-2-4-8-13(11)15)12-7-3-5-9-14(12)16/h10-12H,2-9H2,1H3
InChI Key:
OABJJHZQWSVSPI-UHFFFAOYSA-N
SMILES:
O=C1CCCCC1C(C1CCCCC1=O)C
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.162g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.328g/mol
Monoisotopic Mass:
222.162g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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