Cas no 25054-74-4 (1-Dodecanaminium,N-(carboxymethyl)-N-dodecyl-N-methyl-, inner salt)
25054-74-4 structure
Product Name:1-Dodecanaminium,N-(carboxymethyl)-N-dodecyl-N-methyl-, inner salt
CAS No:25054-74-4
MF:C27H55NO2
MW:425.731108903885
CID:255116
PubChem ID:90696
Update Time:2025-04-19
1-Dodecanaminium,N-(carboxymethyl)-N-dodecyl-N-methyl-, inner salt Chemical and Physical Properties
Names and Identifiers
-
- 1-Dodecanaminium,N-(carboxymethyl)-N-dodecyl-N-methyl-, inner salt
- (Carboxylatomethyl)didodecylmethylammonium
- [didodecyl(methyl)ammonio]acetate
- Dilaurylmethylbetaine
- EINECS 246-583-7
- 25054-74-4
- 1-Dodecanaminium, N-(carboxymethyl)-N-dodecyl-N-methyl-, inner salt
- DTXSID1067045
-
- Inchi： 1S/C27H55NO2/c1-4-6-8-10-12-14-16-18-20-22-24-28(3,26-27(29)30)25-23-21-19-17-15-13-11-9-7-5-2/h4-26H2,1-3H3
- InChI Key： SENWRKVQPDECGF-UHFFFAOYSA-N
- SMILES： [O-]C(C[N+](C)(CCCCCCCCCCCC)CCCCCCCCCCCC)=O
Computed Properties
- Exact Mass: 425.42355
- Monoisotopic Mass: 425.423
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 30
- Rotatable Bond Count: 23
- Complexity: 340
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 11.7
- Topological Polar Surface Area: 40.1?2
Experimental Properties
- PSA: 40.13
1-Dodecanaminium,N-(carboxymethyl)-N-dodecyl-N-methyl-, inner salt Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
25054-74-4 (1-Dodecanaminium,N-(carboxymethyl)-N-dodecyl-N-methyl-, inner salt) Related Products
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