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117203-16-4 | 2-Oxetanone, 4-methyl-3-methylene-
CAS No: 117203-16-4 Catalog No: AG000DXQ MDL No:
Product Description
Catalog Number:
AG000DXQ
Chemical Name:
2-Oxetanone, 4-methyl-3-methylene-
CAS Number:
117203-16-4
Molecular Formula:
C5H6O2
Molecular Weight:
98.0999
IUPAC Name:
4-methyl-3-methylideneoxetan-2-one
InChI:
InChI=1S/C5H6O2/c1-3-4(2)7-5(3)6/h4H,1H2,2H3
InChI Key:
ABPAZYHRDOVNLH-UHFFFAOYSA-N
SMILES:
CC1OC(=O)C1=C
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
98.037g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
98.101g/mol
Monoisotopic Mass:
98.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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