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Structure

Calcium Stearate

CAS
1592-23-0
Catalog Number
ACM1592230
Category
Other Products
Molecular Weight
607.02
Molecular Formula
C36H70CaO4

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Specification

Description
Calcium stearate is carboxylate of calcium, classified as a calcium soap. It is a component of some lubricants, surfactants, as well as many foodstuffs. It is a white waxy powder.
Synonyms
Calcium octadecanoate
IUPAC Name
Calcium;octadecanoate
Canonical SMILES
CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Ca+2]
InChI
CJZGTCYPCWQAJB-UHFFFAOYSA-L
InChI Key
InChI=1S/2C18H36O2.Ca/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2*2-17H2,1H3,(H,19,20);/q;;+2/p-2
Melting Point
147-149 °C
Flash Point
162.4ºC
Density
1.08g/ml
Solubility
0.004 G/100 CC H₂O AT 15 °C; INSOL IN ALCOHOL & ETHER;Slightly sol in hot vegetable and mineral oils; quite sol in hot pyridine;Solubility in water, g/100ml at 15 °C: 0.004
Appearance
White solid
Active Content
95%
Color/Form
CRYSTALLINE POWDER;Granular, fatty powder;FINE, WHITE TO YELLOWISH WHITE, BULKY POWDER
Complexity
196
Covalently-Bonded Unit Count
3
Decomposition
When heated to decomposition it emits acrid smoke and irritating fumes.
EC Number
216-472-8;266-106-6;616-781-1
Exact Mass
606.490002g/mol
Formal Charge
0
Hazard Codes
Xn
Hazard Statements
Xn
H-Bond Acceptor
4
H-Bond Donor
0
Heavy Atom Count
41
HS Code
2915709000
ICSC Number
1506
LogP
12.51080
MDL Number
MFCD00036390
Monoisotopic Mass
606.490002g/mol
Other Experimental
Decomp by many acids and alkalies
pH
7-9
Physical State
Solid
PSA
52.6
Rotatable Bond Count
30
RTECS Number
WI3000000
Safety Description
22-24/25-36-26
Stability
Stable under normal temperatures and pressures.
Storage Conditions
Store in a cool, dry, well-ventilated area away from incompatible substances. Keep containers tightly closed.
UNII
776XM7047L
WGK Germany
What is the molecular formula of calcium stearate?

The molecular formula of calcium stearate is C36H70O4.Ca.

What is the molecular weight of calcium stearate?

The molecular weight of calcium stearate is 607.0 g/mol.

What is the IUPAC name of calcium stearate?

The IUPAC name of calcium stearate is calcium octadecanoate.

What are some synonyms for calcium stearate?

Some synonyms for calcium stearate include calcium octadecanoate, calcium distearate, and calcium stearate 1592-23-0.

What is the InChIKey of calcium stearate?

The InChIKey of calcium stearate is CJZGTCYPCWQAJB-UHFFFAOYSA-L.

What is the CAS number for calcium stearate?

The CAS number for calcium stearate is 1592-23-0.

How many hydrogen bond acceptor counts does calcium stearate have?

Calcium stearate has 4 hydrogen bond acceptor counts.

What is the exact mass of calcium stearate?

The exact mass of calcium stearate is 606.4900016 g/mol.

What is the topological polar surface area of calcium stearate?

The topological polar surface area of calcium stearate is not provided in the reference.

What component compounds make up calcium stearate?

Calcium stearate is made up of calcium (CID 5460341) and stearic acid (CID 5281).

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