Name: 4-cyclohexyl-4-methoxycyclohexan-1-one
SMILES:
COC1(CCC(=O)CC1)C2CCCCC2Molecular Processing
Molecular formula
C13H22O2
Molecular weight
210.32
Exact mass
210.162
XLogP
3.1
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.923
Molar refractivity
59.79
Supplementary Information
InChIKey: YULZPVVASGLNGX-UHFFFAOYSA-N
Synonyme
SCHEMBL6132332YULZPVVASGLNGX-UHFFFAOYSA-N1-methoxy-1,1'-bicyclohexane-4-one
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