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1317-37-9 molecular structure
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sulfanylideneiron

ChemBase ID: 158364
Molecular Formular: FeS
Molecular Mass: 87.91
Monoisotopic Mass: 87.9070085
SMILES and InChIs

SMILES:
S=[Fe]
Canonical SMILES:
S=[Fe]
InChI:
InChI=1S/Fe.S
InChIKey:
MBMLMWLHJBBADN-UHFFFAOYSA-N

Cite this record

CBID:158364 http://www.chembase.cn/molecule-158364.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
sulfanylideneiron
IUPAC Traditional name
iron(II) sulfide
Synonyms
Ferrous sulfide
Iron(II) sulfide
硫化亚铁(II)
硫化亚铁
硫化铁(II)
CAS Number
1317-37-9
EC Number
215-268-6
MDL Number
MFCD00011013
Merck Index
144058
PubChem SID
24847581
162252500
24861125
24856290
PubChem CID
14828

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.7828  LogD (pH = 7.4) 0.7828 
Log P 0.7828  Molar Refractivity 9.4338 cm3
Polarizability 6.956006 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
Soluble in acids with H2S evolution expand Show data source
Apperance
-100 Mesh Powder expand Show data source
sticks (thin) expand Show data source
Melting Point
1195°C expand Show data source
Density
4.74 expand Show data source
4.84 g/mL at 25 °C(lit.) expand Show data source
Storage Warning
Moisture Sensitive expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
UN Number
3077 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
9 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
31 expand Show data source
31-50 expand Show data source
Safety Statements
60 expand Show data source
60-61 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS09 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H400 expand Show data source
GHS Precautionary statements
P273 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Eyeshields, Gloves expand Show data source
RID/ADR
UN 3077 9/PG 3 expand Show data source
Supplemental Hazard Statements
Contact with acids liberates toxic gas. expand Show data source
Purity
≥50.0% expand Show data source
25-30% (S) expand Show data source
99% (metals basis) expand Show data source
99.9% trace metals basis expand Show data source
Grade
SAJ first grade expand Show data source
technical expand Show data source
technical grade expand Show data source
Particle Size
-100 mesh expand Show data source
Impurities
≥29% sulfide (S) expand Show data source
Empirical Formula (Hill Notation)
FeS expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 268704 external link
Features and Benefits
Non-stoichiometric, inhomogeneous product
Packaging
250 g in poly bottle
5 g in glass bottle
Sigma Aldrich - 343161 external link
Packaging
10, 50 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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