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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.

External Resources

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

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