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Molecule
Hydrotalcite (Mg6(Co3)[Al(Oh)6]2(Oh)4.4H2O)
CAS: 12304-65-3 · CH9AlMgO11-4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 12304-65-3
- Molecular Formula
- CH9AlMgO11-4
- Molecular Mass
- 248.36 g/mol
Identifiers
CAS Registry Number
12304-65-3
SMILES
O.O=C([O-])[O-].[Al+3].[Mg+2].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-]
InChI Key
AZCAEQSTFJXPFQ-UHFFFAOYSA-E
InChI
InChI=1S/CH2O3.Al.Mg.8H2O/c2-1(3)4;;;;;;;;;;/h(H2,2,3,4);;;8*1H2/q;+3;+2;;;;;;;;/p-9
Names and Synonyms
- Hydrotalcite (Mg6(Co3)[Al(Oh)6]2(Oh)4.4H2O) Common Name
- Arukamak SH Synonym
- Hydrotalcite (Mg6(CO3)[Al(OH)6]2(OH)4.4H2O) Synonym
- Hydrotalcite Synonym
- Talcid Synonym
- Altacite Synonym
- Nacid Synonym
- DHT 44 Synonym
- DHT Synonym
- C 300 Synonym
- Sorbplus PM Synonym
- C 300 (mineral) Synonym
- Hysafe 539 Synonym
- EXM 697-2 Synonym
- CT 100 Synonym
- AHT-XA Synonym
- IXE 700F Synonym
- CLC 120 Synonym
- KW 900A Synonym
- RUP 118 Synonym
- Hydrotalcite [Mg6Al2(OH)16CO3.4H2O] Synonym
- Alcamac SN Synonym
- Hytal Synonym
- Sorbacid 939 Synonym
- Sorbacid 911 Synonym
- ALCA 4 Synonym
- Perkalite Synonym
- HT 5-4 Synonym
- HT 373 Synonym
- Syntal HSA 696 Synonym
- C 104 Synonym
- C 104 (mineral) Synonym
- Hycite 713 Synonym
- NA 0X19 Synonym
- LD 80 Synonym
- Syntal 696 Synonym
- HT 1R-NC Synonym
- Pural MG 63ABSA Synonym
- Magcelar 1 Synonym
- AS 01 Synonym
- Naox 33 Synonym
- AC 106 Synonym
- JAM 6 Synonym
- MA 20 Synonym
- AC 207 Synonym
- Actisorb RU Synonym
- FMD Synonym
- AC 109 Synonym
- Kyowaad 500SNG Synonym
- FM 300 Synonym
- Hi-Tal P 1 Synonym
- HT 33 Synonym
- EXM 2152 Synonym
- EXM 2003 Synonym
- AC 207 (mineral) Synonym
- LDH 40 Synonym
- RX 30-4B Synonym
- Nano X 33 Synonym
- D 97 Synonym
- Sakai HTV Synonym
- Sakai HTP Synonym
- N 100 Synonym
- N 100 (mineral) Synonym
- DBC 300 Synonym
- HT 12 Synonym
- Jinxin HT 12 Synonym
- HT 6 Synonym
- HT 100 Synonym
- HT 100 (mineral) Synonym
- HT 6 (mineral) Synonym
- Aluminate(3-), hexahydroxy-, carbonate (1:1) Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 248.36 g/mol | CAS Common Chemistry |
| 248.35900000000004 g/mol | RDKit | |
| 248.359 g/mol | RDKit | |
| 258.439 g/mol | chempirical lib | |
| Canonical SMILES | [Mg+2].[OH-].O=C([O-])[O-].O.[OH-][Al+3]([OH-])([OH-])([OH-])([OH-])[OH-] | CAS Common Chemistry |
| InChI | InChI=1S/CH2O3.Al.Mg.8H2O/c2-1(3)4;;;;;;;;;;/h(H2,2,3,4);;;8*1H2/q;+3;+2;;;;;;;;/p-9 | CAS Common Chemistry |
| InChI Key | InChIKey=AZCAEQSTFJXPFQ-UHFFFAOYSA-E | CAS Common Chemistry |
| Name | Hydrotalcite (Mg6(CO3)[Al(OH)6]2(OH)4.4H2O) | CAS Common Chemistry |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 10 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 304.69 Ų | RDKit |
| LogP | -5.270899999999999 | RDKit |
| -5.2709 | RDKit | |
| Molar Refractivity | 34.0684 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | -4 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 247.98326075764004 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
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60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 248.36 g/mol. Edit any field — others recompute live.
