isododecylbenzenesulfonic acid (Q111206812)

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chemical compound

• 4-(10-methylundecyl)benzenesulfonic acid

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Language	Label	Description	Also known as
English	isododecylbenzenesulfonic acid	chemical compound	4-(10-methylundecyl)benzenesulfonic acid

Statements

instance of

type of chemical entity

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subclass of

dodecylbenzenesulfonic acids

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chemical structure

Isododecylbenzenesulfonic acid.svg
995 × 250; 12 KB

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mass

326.19156582 dalton

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based on heuristic

inferred from InChI

chemical formula

C₁₈H₃₀O₃S

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canonical SMILES

CC(C)CCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O

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Identifiers

InChI

InChI=1S/C18H30O3S/c1-16(2)10-8-6-4-3-5-7-9-11-17-12-14-18(15-13-17)22(19,20)21/h12-16H,3-11H2,1-2H3,(H,19,20,21)

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InChIKey

NLIZZNXFRGDAMS-UHFFFAOYSA-N

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CAS Registry Number

751478-60-1

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PubChem CID

110200

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matched by identifier from

InChIKey

InChIKey

NLIZZNXFRGDAMS-UHFFFAOYSA-N

UniChem compound ID

24902451

1 reference

stated in

UniChem

 

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