CCCC1CCC(C2CCC(CCI)CC2)CC1
Name: 1-(2-iodoethyl)-4-(4-propylcyclohexyl)cyclohexane
SMILES: CCCC1CCC(C2CCC(CCI)CC2)CC1

Molecular Processing

Molecular formula
C17H31I
Molecular weight
362.34
Exact mass
362.147
XLogP
6.22
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
1
Molar refractivity
89.31

Supplementary Information

InChIKey: VIRJOZGDCJMRTR-UHFFFAOYSA-N
Synonyme
SCHEMBL9561964SCHEMBL9561966VIRJOZGDCJMRTR-UHFFFAOYSA-N2-(4'-propylbicyclohexyl-4-yl)-1-iodoethane
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