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18218-27-4 | Cyclobutanol, 3-methylene-, 1-acetate
CAS No: 18218-27-4 Catalog No: AG0023G0 MDL No:
Product Description
Catalog Number:
AG0023G0
Chemical Name:
Cyclobutanol, 3-methylene-, 1-acetate
CAS Number:
18218-27-4
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
IUPAC Name:
(3-methylidenecyclobutyl) acetate
InChI:
InChI=1S/C7H10O2/c1-5-3-7(4-5)9-6(2)8/h7H,1,3-4H2,2H3
InChI Key:
GECKEGSNKRNFFT-UHFFFAOYSA-N
SMILES:
CC(=O)OC1CC(=C)C1
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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