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15839-23-3 | Cyclohexanone, 2-[(1-methylethoxy)methylene]-
CAS No: 15839-23-3 Catalog No: AG001Q5R MDL No:
Product Description
Catalog Number:
AG001Q5R
Chemical Name:
Cyclohexanone, 2-[(1-methylethoxy)methylene]-
CAS Number:
15839-23-3
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
IUPAC Name:
2-(propan-2-yloxymethylidene)cyclohexan-1-one
InChI:
InChI=1S/C10H16O2/c1-8(2)12-7-9-5-3-4-6-10(9)11/h7-8H,3-6H2,1-2H3
InChI Key:
FAPWCLNNNXMVRO-UHFFFAOYSA-N
SMILES:
CC(OC=C1CCCCC1=O)C
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.236g/mol
Monoisotopic Mass:
168.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.9
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