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1148130-30-6 | Cyclobutaneacetic acid, 3-oxo-, methyl ester
CAS No: 1148130-30-6 Catalog No: AG000FA2 MDL No:MFCD20134006
Product Description
Catalog Number:
AG000FA2
Chemical Name:
Cyclobutaneacetic acid, 3-oxo-, methyl ester
CAS Number:
1148130-30-6
Molecular Formula:
C7H10O3
Molecular Weight:
142.1525
MDL Number:
MFCD20134006
IUPAC Name:
methyl 2-(3-oxocyclobutyl)acetate
InChI:
InChI=1S/C7H10O3/c1-10-7(9)4-5-2-6(8)3-5/h5H,2-4H2,1H3
InChI Key:
UJPOOJZMVQMLOM-UHFFFAOYSA-N
SMILES:
COC(=O)CC1CC(=O)C1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.063g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.154g/mol
Monoisotopic Mass:
142.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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