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4-(1'-Heptylnonyl)Benzenesulfonate
[CAS# 67267-95-2]

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CAS#: 67267-95-2
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Identification
Name 4-(1'-Heptylnonyl)Benzenesulfonate
Synonyms Sodium 4-(1-Heptylnonyl)Benzenesulfonate; Shbs; 4-(1'-Heptylnonyl)Benzenesulfonate
Molecular Structure CAS#: 67267-95-2, 4-(1'-Heptylnonyl)Benzenesulfonate
Molecular Formula C22H37NaO3S
Molecular Weight 404.58
CAS Registry Number 67267-95-2
SMILES C1=C([S]([O-])(=O)=O)C=CC(=C1)C(CCCCCCCC)CCCCCCC.[Na+]
InChI 1S/C22H38O3S.Na/c1-3-5-7-9-11-13-15-20(14-12-10-8-6-4-2)21-16-18-22(19-17-21)26(23,24)25;/h16-20H,3-15H2,1-2H3,(H,23,24,25);/q;+1/p-1
InChIKey HMUWJRKMCCROKD-UHFFFAOYSA-M
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