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97-63-2 molecular structure
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ethyl 2-methylprop-2-enoate

ChemBase ID: 123349
Molecular Formular: C6H10O2
Molecular Mass: 114.1424
Monoisotopic Mass: 114.06807956
SMILES and InChIs

SMILES:
C(=O)(C(=C)C)OCC
Canonical SMILES:
CCOC(=O)C(=C)C
InChI:
InChI=1S/C6H10O2/c1-4-8-6(7)5(2)3/h2,4H2,1,3H3
InChIKey:
SUPCQIBBMFXVTL-UHFFFAOYSA-N

Cite this record

CBID:123349 http://www.chembase.cn/molecule-123349.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
ethyl 2-methylprop-2-enoate
IUPAC Traditional name
ethyl methacrylate
Synonyms
ethyl methacrylate
Ethyl methacrylate
Methacrylic acid ethyl ester
Ethyl 2-methylacrylate
甲基丙烯酸乙酯
CAS Number
97-63-2
EC Number
202-597-5
MDL Number
MFCD00009161
Beilstein Number
471201
PubChem SID
24882660
24854062
24884362
24873025
162217702
PubChem CID
7343

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.6645331  LogD (pH = 7.4) 1.6645331 
Log P 1.6645331  Molar Refractivity 31.1662 cm3
Polarizability 12.307829 Å3 Polar Surface Area 26.3 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
-60°C expand Show data source
Boiling Point
118-119 °C(lit.) expand Show data source
118-119°C expand Show data source
Flash Point
18°C(64°F) expand Show data source
19 °C expand Show data source
66.2 °F expand Show data source
Auto Ignition Point
771 °F expand Show data source
Density
0.913 g/mL at 20 °C expand Show data source
0.917 expand Show data source
0.917 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4140 expand Show data source
n20/D 1.413(lit.) expand Show data source
n20/D 1.414 expand Show data source
Vapor Pressure
15 mmHg ( 20 °C) expand Show data source
Vapor Density
>3.9 (vs air) expand Show data source
RTECS
OZ4550000 expand Show data source
European Hazard Symbols
Flammable Flammable (F) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
2277 expand Show data source
UN2277 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
1 expand Show data source
Hazard Class
3 expand Show data source
Packing Group
2 expand Show data source
II expand Show data source
Risk Statements
11-36/37/38-43 expand Show data source
Safety Statements
9-16-29-33 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS07 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H225-H315-H317-H319-H335 expand Show data source
H225-H315-H319-H317-H335 expand Show data source
GHS Precautionary statements
P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
P210-P261-P280-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 2277 3/PG 2 expand Show data source
Storage Temperature
2-8°C expand Show data source
Purity
≥99.0% (GC) expand Show data source
≥99.5% (GC) expand Show data source
98+%, stab. with 100ppm 4-methoxyphenol expand Show data source
99% expand Show data source
Grade
analytical standard expand Show data source
purum expand Show data source
Packaging
ampule of 100 mg expand Show data source
Description
Separate Source expand Show data source
Contains
~0.0015% hydroquinone monomethyl ether as stabilizer expand Show data source
15-20 ppm monomethyl ether hydroquinone as inhibitor expand Show data source
Shelf Life
(limited shelf life, expiry date on the label) expand Show data source
Linear Formula
CH2=C(CH3)COOC2H5 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 234893 external link
Packaging
1 L in glass bottle
100, 500 mL in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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