CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)CCCC(C)CCCC(C)CCCC(C)C
CAS: 100566-23-2
الاسم: 3,7,11,15-tetramethylhexadecyl 4-methylbenzenesulfonate
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)CCCC(C)CCCC(C)CCCC(C)C

Molecular Processing

Molecular formula
C27H48O3S
Molecular weight
452.75
Exact mass
452.3324
XLogP
8.17
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
17
Heavy atoms
31
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
132.82

Supplementary Information

InChIKey: SCFXKCQMEYPYCV-UHFFFAOYSA-N
مرادفات
100566-23-23,7,11,15-Tetramethyl-1-hexadecanol 4-Methylbenzenesulfonatephytanyl tosylateSCHEMBL10725680SCFXKCQMEYPYCV-UHFFFAOYSA-N
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