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Reference substances

Reference substances

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General information

Inventory

EC number:
270-115-0
EC name:
Benzenesulfonic acid, C10-13-alkyl derivs., sodium salts
CAS number:
68411-30-3

No inventory information available

Reference substance information

IUPAC name:
sodium 4-undecylbenzenesulfonate
Synonyms
Names:
Alkyl (C10-13) benzenesulfonic acid, sodium salt
BENZENESULFONIC ACID, 4-C10-13-SEC-ALKYL DERIVATIVES, SODIUM SALTS
Benzenesulfonic acid, C10-13-alkyl derivs., sodium salts
Benzenesulfonic acid,4-C10-13-sec-alkyl derivatives,sodium salts
Benzenesulfonic acid,C10-13-alkyl derivs,sodium salts
Benzenesulfonic acide, C10-13-alkyl derivs., sodium salts
C10-13 ALKYL BENZENESULFONIC ACID, SODIUM SALTS
C10-13 Alkyl Benzenesulfonic Acid, sodium salts
C10-13 Alkyl Benzenesulphonic acid,sodium salts
C10-13-Alkylbenzenesulfonic acid, sodium salt
Linear Alkyl benzene Sulphonic acid, sodium salt
NaLAS
Sodium n-Alkyl-(C10-C13) Benzene Sulfonate
Identifier:
CAS number
68411-30-3
Identifier:
IUPAC name
Benzenesulfonic acid, C10-13-alkyl derivs., sodium salts
Identifier:
IUPAC name
Benzenesulfonic acid, C10-13-alkyl derivs., sodium salts
Identifier:
IUPAC name
Benzenesulfonic acid, C10-13-alkyl derivs., sodium salts
Identifier:
IUPAC name
Benzenesulfonic acid, C10-13-alkyl derivs., sodium salts
Identifier:
IUPAC name
Benzenesulfonic acid,C10-13-alkyl derivs,sodium salts
Identifier:
IUPAC name
Sodium 4-undecylbenzenesulfonate
Identifier:
IUPAC name
Sodium, alkyl-(C10-C13)-benzenesulfonate
Identifier:
IUPAC name
benzenesulfonic acid, C10-13-alkyl derivs, sodium salts
Identifier:
other: Molecular formula
(CH)9-12C7H7NaO3S
Identifier:
other: Molecular formula
C16-19 H25-31 NaO3S
Identifier:
other: Molecular formula
C16H25O3SNa - C19H31O3SNa
Identifier:
other: Molecular formula
C17H27NaO3S
Identifier:
other: Molecular formula
C6H4CnH (2n+1)S03Na n=10-13
Identifier:
other: Molecular formula
C6H6O3S
Identifier:
other: Molecular formula
LAS is the sodium salt of linear alkylbenzene sulfonic acid with alkyl carbon chain lengths ranging from C10 to C13 and averaging 11.6. The primary structure is a C10 to C13 linear alkyl chain with a para-substituted benzene sulfonic acid sodium salt group attached at any of the secondary alkyl carbon positions.
Identifier:
other: Molecular formula
LAS is the sodium salt of linear alkylbenzene sulfonic acid with alkyl carbon chain lengths ranging from C10 to C13 and averaging 11.6. The primary structure is a C10 to C13 linear alkyl chain with a para-substituted benzene sulfonic acid sodium salt group attached at any of the secondary alkyl carbon positions. The compositional information is provided in Table 2 at page 22 of CSR.
Identifier:
other: Molecular formula
NaSO3C7H7-(CH2)n with n= 9-12
Identifier:
other: SMILES notation
No available - no a single isomer - see remarks.
Identifier:
other: SMILES notation
None available - not a single isomer
Identifier:
other: InChl
None available - not a single isomer
Identifier:
other: SMILES notation
None available - not a single isomer - see remarks
Identifier:
other: SMILES notation
None available -not a single isomer -see remarks
Identifier:
other: Molecular formula
Not a single one having different isomers. Can be so described: R-C6H4-SO3 - Na+ where R = C10-13
Identifier:
other: InChl
Not applicable
Identifier:
other: InChl
Not applicable
Identifier:
other: Molecular formula
Not applicable for UVCB substances
Identifier:
other: Molecular formula
Not available - not a single isomer - see remarks
Identifier:
other: SMILES notation
Not available - not a single isomer - see remarks
Identifier:
other: Molecular formula
Not available -not a single isomer -see remarks
Identifier:
other: SMILES notation
Not available, not a single isomer
Identifier:
other: InChl
Not available, not a single isomer
Identifier:
other: Molecular formula
R - C6H4 - SO3 - Na R = C10-13
Identifier:
other: Molecular formula
R-C6H4SO3Na with R= straight alkyl chain from C10 to C13
Identifier:
other: Molecular formula
RSO3Na(R=C10~C13)
Identifier:
other: Molecular formula
complex
Identifier:
other: Molecular formula
not applicable
Identifier:
other: Molecular formula
not applicable for UVCB substances
Identifier:
other: SMILES notation
not applicable for UVCB substances
Identifier:
other: InChl
not applicable for UVCB substances

CAS information

CAS number:
68411-30-3

Related substances

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127184-52-5
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CAS number
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25155-30-0
Identifier:
EC number
Identity:
246-680-4

Molecular and structural information

Molecular formula:
C16-19 H25-31 Na O3 S
Molecular weight:
>= 320 - <= 362
SMILES notation:
[Na+].CCCCCCCCCCCc1ccc(cc1)S(=O)(=O)[O-]
InChl:
InChI=1/C17H28O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-16-12-14-17(15-13-16)21(18,19)20;/h12-15H,2-11H2,1H3,(H,18,19,20);/q;+1/p-1
Structural formula:
Chemical structure