Cas no 10044-00-5 (Butanedioic acid,2-sulfo-, 1,4-dihexadecyl ester, sodium salt (1:1))
10044-00-5 structure
Product Name:Butanedioic acid,2-sulfo-, 1,4-dihexadecyl ester, sodium salt (1:1)
CAS No:10044-00-5
MF:C36H69NaO7S
MW:668.983642339706
CID:206081
PubChem ID:23663650
Update Time:2025-04-19
Butanedioic acid,2-sulfo-, 1,4-dihexadecyl ester, sodium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Butanedioic acid,2-sulfo-, 1,4-dihexadecyl ester, sodium salt (1:1)
- sodium 1,4-dihexadecyl sulphonatosuccinate
- sodium,1,4-dihexadecoxy-1,4-dioxobutane-2-sulfonate
- 2,2-Di(2-hexynyl)malonic acid
- AC1L89AR
- AG-G-98642
- CTK5E0839
- Di-hex-2-inyl-malonsaeure
- di-hex-2-ynyl-malonic acid
- dihexadecyl 3-sulfonatosuccinate
- NSC407590
- sodium 1,2-di(hexadecyloxycarbonyl)ethanesulfonate
- sodium dihexadecylsulfosuccinate
- Butanedioicacid, sulfo-, 1,4-dihexadecyl ester, sodium salt (9CI)
- Succinic acid, sulfo-,1,4-dihexadecyl ester, sodium salt (8CI)
- Succinic acid, sulfo-, dihexadecylester, S-sodium salt (7CI)
- 1-Hexadecanol, sulfosuccinate (2:1), S-sodium salt(8CI)
- Dihexadecyl sodium sulfosuccinate
- Sodium dicetyl sulfosuccinate
- Sodiumdicetyl a-sulfosuccinate
- 10044-00-5
- SODIUM 1,4-BIS(HEXADECYLOXY)-1,4-DIOXOBUTANE-2-SULFONATE
- DTXSID00905501
- EINECS 233-147-6
- SCHEMBL5490907
- Sodium 1,4-dihexadecyl sulfonatosuccinate
- sodium;1,4-dihexadecoxy-1,4-dioxobutane-2-sulfonate
- NS00047962
-
- Inchi： 1S/C36H70O7S.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-42-35(37)33-34(44(39,40)41)36(38)43-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h34H,3-33H2,1-2H3,(H,39,40,41);/q;+1/p-1
- InChI Key： OJCVVWVJJBZCGB-UHFFFAOYSA-M
- SMILES： S(C(C(=O)OCCCCCCCCCCCCCCCC)CC(=O)OCCCCCCCCCCCCCCCC)(=O)(=O)[O-].[Na+]
Computed Properties
- Exact Mass: 668.46647
- Monoisotopic Mass: 668.46617
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 45
- Rotatable Bond Count: 36
- Complexity: 755
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 118
Experimental Properties
- PSA: 109.8
Butanedioic acid,2-sulfo-, 1,4-dihexadecyl ester, sodium salt (1:1) Related Literature
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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3. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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