Название: 1-dodecylsulfanyl-3-propan-2-yloxypropan-2-ol
SMILES:
CCCCCCCCCCCCSCC(COC(C)C)OMolecular Processing
Molecular formula
C18H38O2S
Molecular weight
318.57
Exact mass
318.2593
XLogP
5.43
TPSA
29.46
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
16
Heavy atoms
21
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
1
Molar refractivity
96.26
Supplementary Information
InChIKey: OTQYCXFVPQEHDL-UHFFFAOYSA-N
Синонимы
SCHEMBL11732215OTQYCXFVPQEHDL-UHFFFAOYSA-N1-(n-dodecylthio)-3-isopropoxy-2-propanol
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