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LL 100P
CAS: 20344-49-4 | HFeO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
20344-49-4
Molecular Formula:
HFeO2
Molecular Weight:
88.85099999999998 g/mol
Names and Synonyms:
LL 100P
Yellow LL 100P
Duploxide 510P
Iron Hydroxide Oxide (Fe(Oh)O)
Daipyroxide Yellow 8170
Iron hydroxide oxide (Fe(OH)O)
Iron hydroxide oxide (FeO(OH))
Ferrous acid
Ferric(III) acid
Ferric oxyhydroxide (FeO2H)
α-Iron hydroxide
Iron oxide hydroxide (FeO(OH))
Iron oxyhydroxide (FeO(OH))
α-Iron hydroxide oxide (FeOOH)
Iron monoxide monohydroxide
Ferric hydroxide oxide
Ferric hydroxide oxide (FeOOH)
Iron monohydroxide monooxide
Ferric oxide hydroxide
Tarox LL-XLO
E 331
E 331 (oxide)
YLO 2288D
Iron(III) α-oxyhydroxide
Tarox HY 250
Tarox Synthetic Iron Oxide LL-XLO
TSY 1
Depox
Y 48
YM 1100
FEI 16PB
Sicopur Yellow
Tarox LL 100P
Ferronan 2505
Transyellow AC 500
Colortherm Yellow C 10
GEH 101
Colortherm Yellow 10
Tarox Yellow LL 100P
Colortherm 10
CFH 12
CFH 18
Tarox XLO
Iron(III) oxide hydroxide
α-FeOOH
FeOOH
Synthetic lepidocrocite
Ferrosorp DGp
Ferrosorp DGp+K
Ferrosorp DGμ
Identifiers:
SMILES:
[Fe+].[OH-].[O]
InChI:
InChI=1S/Fe.H2O.O/h;1H2;/q+1;;/p-1
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
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.
All Properties
Comprehensive physical and chemical properties
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 88.85 g/mol | Legacy Database |
| cas-canonical-smile | O=[Fe]O None | Legacy Database |
| cas-inchi | InChI=1S/Fe.H2O.O/h;1H2;/q+1;;/p-1 None | Legacy Database |
| cas-inchi-key | InChIKey=AEIXRCIKZIZYPM-UHFFFAOYSA-M None | Legacy Database |
| cas-name | Iron hydroxide oxide (Fe(OH)O) None | Legacy Database |
| LogP | -0.29810000000000003 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 88.85099999999998 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 88.932591772 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 3 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 58.5 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 2.6223 | RDKit |
