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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
4-(tridecan-3-yl)benzene-1-sulfonic acid

Inventory

EC number:
287-494-3
EC name:
Benzenesulfonic acid, 4-C10-13-sec-alkyl derivs.
CAS number:
85536-14-7
CAS number:
85536-14-7
Synonyms
Names:
Benzenesulfonic acid, 4-C10-13-sec-alkyl derivs.
Linear alkylbenzene sulfonic acid
Linear alkylbenzene sulfonic acid
Identifier:
IUPAC name
4-(tridecan-3-yl)benzene-1-sulfonic acid
Identifier:
IUPAC name
Alkylbenzene C10-C13 sec , sulfonation product with sulphur trioxide
Identifier:
IUPAC name
Benzenesulfonic Acid, 4-C10-13-Sec-Alkyl Derivatives
Identifier:
IUPAC name
Benzenesulfonic acid, 4-C1-13-sec-alkyl derivs.
Identifier:
IUPAC name
Benzenesulfonic acid, 4-C10-13-sec-alkyl derivs
Identifier:
IUPAC name
Benzenesulfonic acid, 4-C10-13-sec-alkyl derivs
Identifier:
IUPAC name
Benzenesulfonic acid, 4-C10-13-sec-alkyl derivs.
Identifier:
IUPAC name
Benzenesulfonic acid, 4-C10-13-sec-alkyl derivs.H
Identifier:
common name
Linear alkylbenzene sulfonic acid
Identifier:
other: InChl
1S/C6H6O3S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H,7,8,9)
Identifier:
other: Molecular formula
C16-19H26-32O3S
Identifier:
other: Molecular formula
C16H26SO3; C17H28SO3; C18H30SO3; C19H32SO3
Identifier:
other: Molecular formula
C18H30O3S
Identifier:
other: Molecular formula
C6H6O3S
Identifier:
other: SMILES notation
CCCCCCCCCCCCc1ccccc1S(=O)(=O)O
Identifier:
other: Molecular formula
CH3-(CH2)n-CH[C6H4-p(SO3H)]-(CH2)m-CH3 (n+m=7-10) (n,m=0-10)
Identifier:
other: Molecular formula
HSO3-C6H4-CnH2n+1 with n={10;11;12;13)
Identifier:
other: InChl
InChI=1S/C18H30O3S/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21)
Identifier:
other: Molecular formula
None available - not a single isomer
Identifier:
other: SMILES notation
None available - not a single isomer
Identifier:
other: Molecular formula
None available - not a single isomer (see structural formaula)
Identifier:
other: SMILES notation
None available -not a single isomer - see remarks
Identifier:
other: SMILES notation
None available. Not a single isomer. See the remarks
Identifier:
other: Molecular formula
Not a single isomer - see remarks
Identifier:
other: SMILES notation
Not a single isomer - see remarks
Identifier:
other: InChl
Not applicable
Identifier:
other: SMILES notation
Not applicable for UVCB
Identifier:
other: InChl
Not applicable for UVCB
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
SO3C7H8-(CH2)n with n= 9-12
Identifier:
other: SMILES notation
c1ccc(cc1)S(=O)(=O)O
Identifier:
other: Molecular formula
n.a.
Identifier:
other: SMILES notation
n.a.
Identifier:
other: SMILES notation
not applicable
Identifier:
other: InChl
not applicable
Identifier:
other: Molecular formula
not applicable as UVCB substance
Benzenesulfonic acid, 4-C10-13-sec-alkyl derivs.

Molecular and structural information

Molecular formula:
None available - not a single isomer - see remarks
Molecular weight:
ca. 312
SMILES notation:
None available - not a single isomer - see remarks
InChl:
Not available
Structural formula:
Chemical structure

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CAS number
Identity:
125301-81-7
Identifier:
CAS number
Identity:
68584-22-5