Home Other Building Blocks Cyclopentaneacetic acid, a,2-dioxo-, methyl ester

Cyclopentaneacetic acid, a,2-dioxo-, methyl ester

CAS No.:
63053-54-3
Catalog Number:
AG019KP2
Molecular Formula:
C8H10O4
Molecular Weight:
170.1626
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Product Description
Catalog Number:
AG019KP2
Chemical Name:
Cyclopentaneacetic acid, a,2-dioxo-, methyl ester
CAS Number:
63053-54-3
Molecular Formula:
C8H10O4
Molecular Weight:
170.1626
MDL Number:
MFCD06644285
IUPAC Name:
methyl 2-oxo-2-(2-oxocyclopentyl)acetate
InChI:
InChI=1S/C8H10O4/c1-12-8(11)7(10)5-3-2-4-6(5)9/h5H,2-4H2,1H3
InChI Key:
VTYYHQNFQPOVDL-UHFFFAOYSA-N
SMILES:
COC(=O)C(=O)C1CCCC1=O
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.164g/mol
Monoisotopic Mass:
170.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties