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13765-19-0 molecular structure
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calcium dioxochromiumbis(olate)

ChemBase ID: 126334
Molecular Formular: CaCrO4
Molecular Mass: 156.0717
Monoisotopic Mass: 155.88275696
SMILES and InChIs

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

Cite this record

CBID:126334 http://www.chembase.cn/molecule-126334.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
calcium dioxochromiumbis(olate)
IUPAC Traditional name
calcium chromate(2-)
Synonyms
Calcium chromate (VI)
Calcium monochromate
Calcium Chrome Yellow
C. I. Pigment Yellow 33
Gelbin
Yellow Ultramarine
Calcium chromate
Calcium chromate
铬酸钙
CAS Number
13765-19-0
EC Number
237-66-8
237-366-8
MDL Number
MFCD00049403
PubChem SID
162220671
PubChem CID
26264
Chemspider ID
24471
Wikipedia Title
Calcium_chromate

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Alfa Aesar
43333 external link Add to cart Please log in.

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa -2.30103  H Acceptors
H Donor LogD (pH = 5.5) -6.720884 
LogD (pH = 7.4) -7.0465326  Log P -2.5252 
Molar Refractivity 5.7716 cm3 Polarizability 6.1887565 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
anhydrous
4.5 g/100 mL (0 °C)
2.25 g/100 mL (20 °C)
dihydrate
16.3 g/100mL (20 °C)
18.2 g/100mL (40 °C) in water
expand Show data source
soluble in acid
practically insoluble in alcohol
expand Show data source
Apperance
-20 Mesh expand Show data source
bright yellow powder expand Show data source
Melting Point
2710 °C expand Show data source
Density
3.12 g/cm3 expand Show data source
RTECS
GB2750000 expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Toxic Toxic (T) expand Show data source
UN Number
UN3087 expand Show data source
Hazard Class
5.1 expand Show data source
Packing Group
III expand Show data source
Risk Statements
45-22-50/53 expand Show data source
Safety Statements
53-45-60-61 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS07 expand Show data source
GHS09 expand Show data source
GHS Hazard statements
H272-H400-H410-H302 expand Show data source
GHS Precautionary statements
P221-P210-P220-P280-P301+P312-P501A expand Show data source
Purity
99.9% (metals basis) expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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