Home Carboxys 2-Cyclopentene-1-carboxylicacid,2-methyl-4-oxo-,methylester(9CI)

2-Cyclopentene-1-carboxylicacid,2-methyl-4-oxo-,methylester(9CI)

CAS No.:
128350-67-4
Catalog Number:
AG00AES2
Molecular Formula:
C8H10O3
Molecular Weight:
154.1632
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Product Description
Catalog Number:
AG00AES2
Chemical Name:
2-Cyclopentene-1-carboxylicacid,2-methyl-4-oxo-,methylester(9CI)
CAS Number:
128350-67-4
Molecular Formula:
C8H10O3
Molecular Weight:
154.1632
MDL Number:
MFCD24695868
IUPAC Name:
methyl 2-methyl-4-oxocyclopent-2-ene-1-carboxylate
InChI:
InChI=1S/C8H10O3/c1-5-3-6(9)4-7(5)8(10)11-2/h3,7H,4H2,1-2H3
InChI Key:
LGEQHFPQMQZIGO-UHFFFAOYSA-N
SMILES:
CC1=CC(=O)CC1C(=O)OC
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.063g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.165g/mol
Monoisotopic Mass:
154.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties