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Reference substances

Reference substances

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IUPAC name:
ammonium 2-ethylhexyl hydrogen phosphate

Inventory

EC number:
289-108-9
EC name:
Phosphoric acid, 2-ethylhexyl ester, ammonium salt
CAS number:
86014-62-2
CAS number:
86014-62-2
Synonyms
Names:
Reaction mass of Ammonium mono(2-ethylhexyl)phosphate, Ammonium bis(2- ethylhexyl)phosphate and 2-ethylhexyl diphosphate ammonium salts

Molecular and structural information

Molecular formula:
Ammonium mono(2-ethylhexyl)phosphate: C8H22NO4P
Ammonium bis(2-ethylhexyl)phosphate: C16H38NO4P
2-ethylhexyl diphosphate ammonium salts / esters of 2-ethylhexan-1-ol with diphosphoric acid and their corresponding ammonium salts*: C8H23NO7P2
Molecular weight:
>= 227.24 - <= 339.45
SMILES notation:
Ammonium mono(2-ethylhexyl)phosphate: OP(OCC(CC)CCCC)([O-])=O.[NH4+]
Ammonium bis(2-ethylhexyl)phosphate: O=P(OCC(CC)CCCC)([O-])OCC(CC)CCCC.[NH4+]
2-ethylhexyl diphosphate ammonium salts / esters of 2-ethylhexan-1-ol with diphosphoric acid and their corresponding ammonium salts*: OP(OP(OCC(CC)CCCC)([O-])=O)(O)=O.[NH4+]
InChl:
Ammonium mono(2-ethylhexyl)phosphate: InChI=1S/C8H19O4P.H3N/c1-3-5-6-8(4-2)7-12-13(9,10)11;/h8H,3-7H2,1- 2H3,(H2,9,10,11);1H3
Ammonium bis(2-ethylhexyl)phosphate: InChI=1S/C16H35O4P.H3N/c1-5-9-11-15(7-3)13-19-21(17,18)20-14-16(8-4)12-10-6- 2;/h15-16H,5-14H2,1-4H3,(H,17,18);1H3
2-ethylhexyl diphosphate ammonium salts / esters of 2-ethylhexan-1-ol with diphosphoric acid and their corresponding ammonium salts: InChI=1S/C8H20O7P2.H3N/c1-3-5-6-8(4-2)7-14-17(12,13)15-16(9,10)11;/h8H,3- 7H2,1-2H3,(H,12,13)(H2,9,10,11);1H3
Structural formula:
Chemical structure

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