CNC1CCC(CC1)CCCCCOS(=O)(=O)C
Name: 5-[4-(methylamino)cyclohexyl]pentyl methanesulfonate
SMILES: CNC1CCC(CC1)CCCCCOS(=O)(=O)C

Molecular Processing

Molecular formula
C13H27NO3S
Molecular weight
277.43
Exact mass
277.1712
XLogP
2.3
TPSA
55.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
18
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
1
Molar refractivity
74.07

Supplementary Information

InChIKey: LKOLZAMQRMBFEW-UHFFFAOYSA-N
Synonyme
SCHEMBL27578408LKOLZAMQRMBFEW-JOCQHMNTSA-Ntrans-Methansulfonic acid 5-(4-methyl amino-cyclohexyl)-pentyl estertrans-Methansulfonic acid 5-(4-methyl amino-cyclohexyl)-pentylester
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