Home Other Building Blocks ethyl 2-(3-oxocyclopentyl)acetate

ethyl 2-(3-oxocyclopentyl)acetate

CAS No.:
62457-60-7
Catalog Number:
AG00ECLV
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
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Product Description
Catalog Number:
AG00ECLV
Chemical Name:
ethyl 2-(3-oxocyclopentyl)acetate
CAS Number:
62457-60-7
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
MDL Number:
MFCD18909257
IUPAC Name:
ethyl 2-(3-oxocyclopentyl)acetate
InChI:
InChI=1S/C9H14O3/c1-2-12-9(11)6-7-3-4-8(10)5-7/h7H,2-6H2,1H3
InChI Key:
SAOBKJVHYFWLEL-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC1CCC(=O)C1
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.094g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.208g/mol
Monoisotopic Mass:
170.094g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties