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3290-92-4 molecular structure
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2,2-bis({[(2-methylprop-2-enoyl)oxy]methyl})butyl 2-methylprop-2-enoate

ChemBase ID: 150617
Molecular Formular: C18H26O6
Molecular Mass: 338.39544
Monoisotopic Mass: 338.17293855
SMILES and InChIs

SMILES:
CCC(COC(=O)C(=C)C)(COC(=O)C(=C)C)COC(=O)C(=C)C
Canonical SMILES:
CCC(COC(=O)C(=C)C)(COC(=O)C(=C)C)COC(=O)C(=C)C
InChI:
InChI=1S/C18H26O6/c1-8-18(9-22-15(19)12(2)3,10-23-16(20)13(4)5)11-24-17(21)14(6)7/h2,4,6,8-11H2,1,3,5,7H3
InChIKey:
OKKRPWIIYQTPQF-UHFFFAOYSA-N

Cite this record

CBID:150617 http://www.chembase.cn/molecule-150617.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2,2-bis({[(2-methylprop-2-enoyl)oxy]methyl})butyl 2-methylprop-2-enoate
IUPAC Traditional name
TMPT
Synonyms
TMPTMA
Trimethylolpropane trimethacrylate
2-Ethyl-2-((methacryloyloxy)methyl)propane-1,3-diyl bis(2-methylacrylate)
三羟甲基丙烷三甲基丙烯酸酯
CAS Number
3290-92-4
MDL Number
MFCD00008588
PubChem SID
162244778
24854829
PubChem CID
18689

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 18689 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 4.46566  LogD (pH = 7.4) 4.46566 
Log P 4.46566  Molar Refractivity 89.0229 cm3
Polarizability 35.48203 Å3 Polar Surface Area 78.9 Å2
Rotatable Bonds 13  Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Flash Point
>130 °C expand Show data source
>266 °F expand Show data source
Density
1.06 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
n20/D 1.472(lit.) expand Show data source
Vapor Pressure
<0.01 mmHg ( 20 °C) expand Show data source
Vapor Density
>1 (vs air) expand Show data source
RTECS
TY6675000 expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
2 expand Show data source
Risk Statements
51/53 expand Show data source
Safety Statements
61 expand Show data source
GHS Pictograms
GHS09 expand Show data source
GHS Hazard statements
H411 expand Show data source
GHS Precautionary statements
P273 expand Show data source
Purity
95+% expand Show data source
Grade
technical grade expand Show data source
Contains
250 ppm monomethyl ether hydroquinone as inhibitor expand Show data source
Linear Formula
[H2C=C(CH3)CO2CH2]3CC2H5 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 246840 external link
Packaging
100, 500 g in poly bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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