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765-85-5 | Methyl cyclobutanecarboxylate
CAS No: 765-85-5 Catalog No: AG003RZX MDL No:MFCD00095142
Product Description
Catalog Number:
AG003RZX
Chemical Name:
Methyl cyclobutanecarboxylate
CAS Number:
765-85-5
Molecular Formula:
C6H10O2
Molecular Weight:
114.1424
MDL Number:
MFCD00095142
IUPAC Name:
methyl cyclobutanecarboxylate
InChI:
InChI=1S/C6H10O2/c1-8-6(7)5-3-2-4-5/h5H,2-4H2,1H3
InChI Key:
CBTGNLZUIZHUHY-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCC1
Properties
Complexity:
94.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
114.068g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
114.144g/mol
Monoisotopic Mass:
114.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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