Home Other Building Blocks 3-Oxetanone, 2,2-dimethyl-

3-Oxetanone, 2,2-dimethyl-

CAS No.:
86096-10-8
Catalog Number:
AG00ILFC
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
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Product Description
Catalog Number:
AG00ILFC
Chemical Name:
3-Oxetanone, 2,2-dimethyl-
CAS Number:
86096-10-8
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
IUPAC Name:
2,2-dimethyloxetan-3-one
InChI:
InChI=1S/C5H8O2/c1-5(2)4(6)3-7-5/h3H2,1-2H3
InChI Key:
YFOSTDMTAXUXED-UHFFFAOYSA-N
SMILES:
O=C1COC1(C)C
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.052g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
100.117g/mol
Monoisotopic Mass:
100.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties