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1019842-24-0 | Cyclobutanepropanoic acid, 3-oxo-, methyl ester
CAS No: 1019842-24-0 Catalog No: AG00065T MDL No:MFCD19441111
Product Description
Catalog Number:
AG00065T
Chemical Name:
Cyclobutanepropanoic acid, 3-oxo-, methyl ester
CAS Number:
1019842-24-0
Molecular Formula:
C8H12O3
Molecular Weight:
156.1791
MDL Number:
MFCD19441111
IUPAC Name:
methyl 3-(3-oxocyclobutyl)propanoate
InChI:
InChI=1S/C8H12O3/c1-11-8(10)3-2-6-4-7(9)5-6/h6H,2-5H2,1H3
InChI Key:
RJKVUZPDPUYBCD-UHFFFAOYSA-N
SMILES:
COC(=O)CCC1CC(=O)C1
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.181g/mol
Monoisotopic Mass:
156.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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