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Sodium N-(2-carboxyethyl)-N-(2-ethylhexyl)-beta-alaninate

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Name

Sodium N-(2-carboxyethyl)-N-(2-ethylhexyl)-beta-alaninate

EINECS 305-318-6
CAS No. 94441-92-6 Density g/cm3
PSA 83.50000 LogP -0.21520
Solubility 760g/L at 20℃ Melting Point N/A
Formula C14H27 N O4 . Na Boiling Point °Cat760mmHg
Molecular Weight 317.33214 Flash Point °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 94441-92-6 (sodium N-(2-carboxyethyl)-N-(2-ethylhexyl)-beta-alaninate) Hazard Symbols N/A
Synonyms

b-Alanine,N-(2-carboxyethyl)-N-(2-ethylhexyl)-, monosodium salt (9CI);Amphotensid EH;

 

Sodium N-(2-carboxyethyl)-N-(2-ethylhexyl)-beta-alaninate Specification

The Sodium N-(2-carboxyethyl)-N-(2-ethylhexyl)-beta-alaninate, with the CAS registry number 94441-92-6, is also known as beta-Alanine, N-(2-carboxyethyl)-N-(2-ethylhexyl)-,monosodium salt.It belongs to the product categories of Pharmaceuticals.Its EINECS number is 305-318-6. What's more,Its systematic name is Sodium N-(2-carboxyethyl)-N-(2-ethylhexyl)-beta-alaninate.Physical properties about Sodium N-(2-carboxyethyl)-N-(2-ethylhexyl)-beta-alaninate are:(1)#h bond acceptors:  5; (2)#h bond donors:  2; (3)#freely rotating bonds:  12.

You can still convert the following datas into molecular structure:
(1)SMILES:[Na+].OC(=O)CCN(CC(CCCC)CC)CCC([O-])=O;
(2)Std. InChI:InChI=1S/C14H27NO4.Na/c1-3-5-6-12(4-2)11-15(9-7-13(16)17)10-8-14(18)19;/h12H,3-11H2,1-2H3,(H,16,17)(H,18,19);/q;+1/p-1;
(3)Std. InChIKey:WVQFKDGIJVWORA-UHFFFAOYSA-M.

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