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Molecule
ID:110233
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₃₆H₇₀MgO₄
Molecular Mass
591.2436
Exact Mass
590.51245242
Charge
0
InChI
InChI=1S/2C18H36O2.Mg/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
InChIKey
HQKMJHAJHXVSDF-UHFFFAOYSA-L
Canonic Smiles
CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Mg+2]
Isomeric Smiles
[Mg+2].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-]
Calculated Properties
JChem
LogD (pH = 7.4)
4.73
LogD (pH = 5.5)
6.49
Log P
7.15
Rotatable Bonds
32
H Donor
0
H Acceptors
2
Lipinski's Rule of Five
false
Acid pKa
4.95
Polar Surface Area
40.13
Polarizability
38.18
Molar Refractivity
97.12
LOG S
-7.67
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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General Information
Calculated Properties
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RDKit
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JChem
Data Source
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Academic Data
Names and Identifiers
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IUPAC Traditional name
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IUPAC name
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Synonyms
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Physical Property
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Product Information
Related Proteins
Molecular Spectra
Molecule Details
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MP Biomedicals
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Wikipedia
References
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PubChem Literature
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From Data Sources
Bioactivity
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PubChem BioAssay
Data Source
Commercial Catalog
MP Biomedicals
05214200
Alfa Aesar
A16244
Academic Data
Wikipedia
Magnesium_stearate
PubChem
11177
ChEBI
CHEBI:9254
Names and Identifiers
IUPAC Traditional name
magnesium(2+) bis(formula 300)
magnesium(2+) ion bis(n-octadecanoate)
magnesium stearate
IUPAC name
magnesium(2+) ion dioctadecanoate
magnesium(2+) dioctadecanoate
Synonyms
MAGNESIUM STEARATE
Magnesium stearate
硬脂酸镁
Stearic acid magnesium salt
magnesium distearate
Magnesium stearate
magnesium distearate
magnesium octadecanoate
Registration numbers
CAS Number
557-04-0
EC Number
209-150-3
Wikipedia Title
Magnesium_stearate
Unique Ingredient Identifier
70097M6I30
CHEBI ID
9254
CHEBI:9254
Chemspider ID
10704
PubChem CID
11177
PubChem SID
162095588
8146004
MDL Number
MFCD00036391
Merck Index
145690
ACToR Database
557-04-0
212132-26-8
UniProt Database
P34913
P80299
P14630
O95445
Q2LE37
Q6Q2C2
O81445
Q5R894
P21625
O22832
Q6US81
Q86YN6
Q9Z1R3
Q8S059
Q5SKN9
P34914
G8BAW7
Q8LAS7
Q5B7V0
P19215
Q9SJE2
Reactom Database
R-HSA-428262
R-HSA-6803753
R-HSA-428231
R-HSA-749452
R-HSA-2404140
R-HSA-428205
R-HSA-379048
R-HSA-5627891
R-HSA-444191
R-HSA-2453833
R-HSA-2404133
R-HSA-2429643
R-HSA-879585
R-HSA-383313
R-HSA-749448
Gmelin ID
777020
Beilstein Number
3919702
BRENDA Ligand Database
165868
SureChEMBL Database
SCHEMBL935
KEGG DRUG Database
D02189
BKMS React Database
165868
CHEMBL
CHEMBL2106633
BRENDA Database
2.4.1.262
CompTox Database
DTXSID2027208
Molecule Details
MP Biomedicals
05214200
MP Biomedicals Rare Chemical collection
Wikipedia
Magnesium_stearate
References
PubChem Literature
No Data Available
Click here to submit data
Bioactivity
PubChem BioAssay
Registration numbers
•
CAS Number
•
EC Number
•
Wikipedia Title
•
Unique Ingredient Identifier
•
CHEBI ID
•
Chemspider ID
•
PubChem CID
•
PubChem SID
•
MDL Number
•
Merck Index
•
ACToR Database
•
UniProt Database
•
Reactom Database
•
Gmelin ID
•
Beilstein Number
•
BRENDA Ligand Database
•
SureChEMBL Database
•
KEGG DRUG Database
•
BKMS React Database
•
CHEMBL
•
BRENDA Database
•
CompTox Database
Properties
Physical Property
Melting Point
88°C
Source
88.5°C
Source
148-152°C
Source
Solubility
0.003 g/100 mL (15 °C)
0.004 g/100 mL (25 °C)
0.008 g/100 mL (50 °C) in water
Source
negliglble in ether and alcohol
slightly soluble in benzene
Source
Apperance
light white powder
Source
Odor
slight
Source
Density
1.026 g/cm
3
Source
Safety Information
European Hazard Symbols
Flammable (F)
Source
R:
15
-
17
Source
53
Source
WI4390000
Source
Download link
Source
S:
7/8
Source
61
Source
P273
-P501A
Source
H413
Source
是
Source
Product Information
Certificate of Analysis
Download link
Source
Risk Statements
RTECS
MSDS Link
Safety Statements
GHS Precautionary statements
GHS Hazard statements
TSCA Listed