Home Carboxys Ethyl 2-methyl-4-oxocyclopent-2-ene-1-carboxylate

Ethyl 2-methyl-4-oxocyclopent-2-ene-1-carboxylate

CAS No.:
17790-74-8
Catalog Number:
AG0025LM
Molecular Formula:
C9H12O3
Molecular Weight:
168.1898
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
95%
In Stock USA
United States
$400
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Product Description
Catalog Number:
AG0025LM
Chemical Name:
Ethyl 2-methyl-4-oxocyclopent-2-ene-1-carboxylate
CAS Number:
17790-74-8
Molecular Formula:
C9H12O3
Molecular Weight:
168.1898
MDL Number:
MFCD24688643
IUPAC Name:
ethyl 2-methyl-4-oxocyclopent-2-ene-1-carboxylate
InChI:
InChI=1S/C9H12O3/c1-3-12-9(11)8-5-7(10)4-6(8)2/h4,8H,3,5H2,1-2H3
InChI Key:
FIOFMYNFIRAGTI-UHFFFAOYSA-N
SMILES:
CC1=CC(=O)CC1C(=O)OCC
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.079g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.192g/mol
Monoisotopic Mass:
168.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties