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26248-24-8

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Basic Information
CAS No.: 26248-24-8
Name: SODIUM N-TRIDECYLBENZENESULFONATE
Molecular Structure:
Molecular Structure of 26248-24-8 (SODIUM N-TRIDECYLBENZENESULFONATE)
Formula: C19H31NaO3S
Molecular Weight: 362.5
Synonyms: Benzenesulfonicacid, tridecyl-, sodium salt (6CI,8CI,9CI);Conoco C 650;Sodiumn-tridecylbenzenesulfonate;Sodium tridecylbenzenesulfonate;Tridecylbenzenesulfonic acid sodium salt;
EINECS: 247-536-3
PSA: 65.58000
LogP: 6.52500
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    Benzenesulfonic acid,tridecyl-, sodium salt (1:1)

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    factory?direct?sale Application:Fine chemical intermediates, used as the main raw material for the synthesis of various pesticides, medicines, surfactants, polymer monomers, and antifungal agents

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Specification

The CAS register number of Benzenesulfonic acid,tridecyl-, sodium salt (1:1) is 26248-24-8. It also can be called as Tridecylbenzenesulfonic acid sodium salt and the systematic name about this chemical is sodium 4-tridecylbenzenesulfonate. The molecular formula about this chemical is C19H31NaO3S and the molecular weight is 362.5.

Physical properties about Benzenesulfonic acid,tridecyl-, sodium salt (1:1) are: (1)ACD/LogP: 7.31; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 3.81; (4)ACD/LogD (pH 7.4): 3.81; (5)ACD/BCF (pH 5.5): 66.72; (6)ACD/BCF (pH 7.4): 66.49; (7)ACD/KOC (pH 5.5): 71.3; (8)ACD/KOC (pH 7.4): 71.05; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 62.75 Å2. 

You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].[O-]S(=O)(=O)c1ccc(cc1)CCCCCCCCCCCCC
(2)InChI: InChI=1/C19H32O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-14-16-19(17-15-18)23(20,21)22;/h14-17H,2-13H2,1H3,(H,20,21,22);/q;+1/p-1
(3)InChIKey: DUXXGJTXFHUORE-REWHXWOFAW
(4)Std. InChI: InChI=1S/C19H32O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-14-16-19(17-15-18)23(20,21)22;/h14-17H,2-13H2,1H3,(H,20,21,22);/q;+1/p-1
(5)Std. InChIKey: DUXXGJTXFHUORE-UHFFFAOYSA-M