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7789-82-4 molecular structure
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calcium dioxomolybdenumbis(olate)

ChemBase ID: 107452
Molecular Formular: CaMoO4
Molecular Mass: 200.0356
Monoisotopic Mass: 201.84765746
SMILES and InChIs

SMILES:
[Ca+2].[O-][Mo](=O)(=O)[O-]
Canonical SMILES:
[O-][Mo](=O)(=O)[O-].[Ca+2]
InChI:
InChI=1S/Ca.Mo.4O/q+2;;;;2*-1
InChIKey:
BIOOACNPATUQFW-UHFFFAOYSA-N

Cite this record

CBID:107452 http://www.chembase.cn/molecule-107452.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
calcium dioxomolybdenumbis(olate)
IUPAC Traditional name
calcium(2+) molybdate
calcium molybdate
Synonyms
CALCIUM MOLYBDATE
Powellite
Calcium molybdate
Calcium molybdenum oxide, Puratronic®
Calcium molybdate
Calcium molybdenum oxide
钼酸钙
钼酸钙, Puratronic®
CAS Number
7789-82-4
EC Number
232-192-9
MDL Number
MFCD00015976
Merck Index
141681
PubChem SID
162093238
24864826
PubChem CID
24620

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa -2.30103  H Acceptors
H Donor LogD (pH = 5.5) -5.970884 
LogD (pH = 7.4) -6.2965326  Log P -1.7752 
Molar Refractivity 5.7716 cm3 Polarizability 7.7780766 Å3
Polar Surface Area 80.26 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
concentrated acid: slightly soluble expand Show data source
ethanol: insoluble expand Show data source
Apperance
powder expand Show data source
Powder expand Show data source
Melting Point
965°C expand Show data source
Density
4.35 g/mL at 25 °C(lit.) expand Show data source
4.38-4.53 expand Show data source
RTECS
EW2975000 expand Show data source
European Hazard Symbols
Toxic Toxic (T) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
3288 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
23/24/25-36/37/38 expand Show data source
36/37/38 expand Show data source
Safety Statements
22-26-36/37/39-45 expand Show data source
26-37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS07 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H301-H311-H315-H319-H331-H335 expand Show data source
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P280-P301 + P310-P305 + P351 + P338-P311 expand Show data source
P261-P305+P351+P338-P302+P352-P321-P405-P501A expand Show data source
RID/ADR
UN 3288 6.1/PG 3 expand Show data source
Purity
99% expand Show data source
99.8% expand Show data source
99.9965% (metals basis) expand Show data source
Particle Size
-325 mesh expand Show data source
Certificate of Analysis
Download expand Show data source
Linear Formula
CaMoO4 expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05203776 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - 399590 external link
Packaging
25 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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