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Home Other Building Blocks Methallyl acetate

Methallyl acetate

CAS No.:
820-71-3
Catalog Number:
AG003HM5
Molecular Formula:
C6H10O2
Molecular Weight:
114.1424
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$32
- +
5g
97%
In Stock USA
United States
$75
- +
10g
97%
In Stock USA
United States
$132
- +
25g
97%
In Stock USA
United States
$163
- +
100g
97%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG003HM5
Chemical Name:
Methallyl acetate
CAS Number:
820-71-3
Molecular Formula:
C6H10O2
Molecular Weight:
114.1424
MDL Number:
MFCD00048215
IUPAC Name:
2-methylprop-2-enyl acetate
InChI:
InChI=1S/C6H10O2/c1-5(2)4-8-6(3)7/h1,4H2,2-3H3
InChI Key:
IVKYUXHYUAMPMT-UHFFFAOYSA-N
SMILES:
CC(=O)OCC(=C)C
EC Number:
212-471-1
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
114.068g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
114.144g/mol
Monoisotopic Mass:
114.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Catalytic enantioselective Grignard Nozaki-Hiyama methallylation from the alcohol oxidation level: chloride compensates for π-complex instability. Chemical communications (Cambridge, England) 20110928
Nitrogen-directed ortho-selective homocoupling of aromatic compounds catalyzed by ruthenium complexes. Organic letters 20080501
Inter- and intramolecular palladium-catalyzed allyl cross-coupling reactions using allylindium generated in situ from allyl acetates, indium, and indium trichloride. Chemistry (Weinheim an der Bergstrasse, Germany) 20070101
Properties