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Molecule
ID:104224
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₃₂H₆₄O₂
Molecular Mass
480.84936
Exact Mass
480.49063129
Charge
0
InChI
InChI=1S/C32H64O2/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-23-25-27-29-31-34-32(33)30-28-26-24-22-12-10-8-6-4-2/h3-31H2,1-2H3
InChIKey
GTUGKPSGIYCKEQ-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC
Isomeric Smiles
CCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
13.0612
LogD (pH = 7.4)
13.0612
Log P
13.0612
Molar Refractivity
150.9383
Polarizability
60.506657
Polar Surface Area
26.3
Rotatable Bonds
30
Lipinski's Rule of Five
false
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General Information
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IUPAC Traditional name
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IUPAC name
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MDL Number
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PubChem CID
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MP Biomedicals
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From Data Sources
Bioactivity
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PubChem BioAssay
Data Source
Commercial Catalog
MP Biomedicals
02155169
Sigma Aldrich
L0506
Academic Data
PubChem
4599241
Names and Identifiers
IUPAC Traditional name
icosyl dodecanoate
Synonyms
Arachidyl laurate
LAURIC ACID ARACHIDYL ESTER
Dodecanoic acid eicosyl ester
Arachidyl dodecanoate
IUPAC name
icosyl dodecanoate
Registration numbers
CAS Number
36617-18-2
MDL Number
MFCD00056264
PubChem SID
24896255
162091923
PubChem CID
4599241
Molecule Details
MP Biomedicals
02155169
(Arachidyl laurate) Purity: 99% Crystalline
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay
Properties
Safety Information
Storage Condition
0°C, Store Under Nitrogen
Source
MSDS Link
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Source
Storage Temperature
-20°C
Source
Personal Protective Equipment
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Source
German water hazard class
3
Source
Product Information
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Source
99%
Source
≥99%
Source
Certificate of Analysis
Purity