이름: 2-ethyl-1-methyl-4-(2-phenylmethoxyethyl)cyclohexan-1-ol
SMILES:
CCC1CC(CCC1(C)O)CCOCC2=CC=CC=C2Molecular Processing
Molecular formula
C18H28O2
Molecular weight
276.42
Exact mass
276.2089
XLogP
4.17
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
82.46
Supplementary Information
InChIKey: XJPPNIZKHLUVSD-UHFFFAOYSA-N
동의어
SCHEMBL1339372XJPPNIZKHLUVSD-UHFFFAOYSA-N4-(2-benzyloxy-ethyl)-2-ethyl-1-methylcyclohexanol4-(2-benzyloxy-ethyl)-2-ethyl-1-methyl-cyclohexanol
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