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Valsynthese, part of the SSE Group, is a CDMO focused on highly energetic and highly hazardous chemistry.

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CHEMISTRY
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Chemistry

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Also known as: Dianeusine, Dialuminum;magnesium;dihydroxy(oxo)silane;hydrate, Almasilatum, Simagel, Almasilate [inn:ban], Almasilatum [inn-latin]

Molecular Formula

Al₂H₆MgO₇Si₂+₈

Molecular Weight

252.48 g/mol

InChI Key

HZVVJJIYJKGMFL-UHFFFAOYSA-N

1 2D Structure

Dianeusine

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

dialuminum;magnesium;dihydroxy(oxo)silane;hydrate

2.1.2 InChI

InChI=1S/2Al.Mg.2H2O3Si.H2O/c;;;2*1-4(2)3;/h;;;2*1-2H;1H2/q2*+3;+2;;;

2.1.3 InChI Key

HZVVJJIYJKGMFL-UHFFFAOYSA-N

2.1.4 Canonical SMILES

O.O[Si](=O)O.O[Si](=O)O.[Mg+2].[Al+3].[Al+3]

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Dianeusine

2. Dialuminum;magnesium;dihydroxy(oxo)silane;hydrate

3. Almasilatum

4. Simagel

5. Almasilate [inn:ban]

6. Almasilatum [inn-latin]

7. Almasilato [inn-spanish]

8. Unii-ozq8o62h53

9. Simagel;almasilate

10. Almasilate C212

11. Magnesiumaluminosilicate

12. Dtxsid30221403

13. Bcp30953

14. Magnesium Aluminosilicate (mgal2si2o8) Hydrate

15. Q4733720

16. Aluminum Magnesium Silicate Hydrate - Almasilate C212

2.3 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	Al₂H₆MgO₇Si₂+₈
Molecular Weight	252.48 g/mol
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	0
Exact Mass	251.913324 g/mol
Monoisotopic Mass	251.913324 g/mol
Topological Polar Surface Area	116 Å²
Heavy Atom Count	12
Formal Charge	8
Complexity	26.3
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	6