名称: 1.2-O-Dihexadecyl-3-methylthio-1.2-propanediol Racemic 1,2-O-dihexadecyl-3-bromo-1,2-propanediol
SMILES:
CCCCCCCCCCCCCCCCOC(CBr)C(O)CCCCCCCCCCCCCCCCMolecular Processing
Molecular formula
C35H71BrO2
Molecular weight
603.85
Exact mass
602.4637
XLogP
12.48
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
33
Heavy atoms
38
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
1
Molar refractivity
174.78
Supplementary Information
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