Home Other Building Blocks 3,5-dimethyloxan-4-one, Mixture of diastereomers

3,5-dimethyloxan-4-one, Mixture of diastereomers

CAS No.:
625099-33-4
Catalog Number:
AG01BV6U
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01BV6U
Chemical Name:
3,5-dimethyloxan-4-one, Mixture of diastereomers
CAS Number:
625099-33-4
MDL Number:
MFCD20484203
IUPAC Name:
3,5-dimethyloxan-4-one
InChI:
InChI=1S/C7H12O2/c1-5-3-9-4-6(2)7(5)8/h5-6H,3-4H2,1-2H3
InChI Key:
VFPBFBJZAMZMKJ-UHFFFAOYSA-N
Properties
Complexity:
108  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.084g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.171g/mol
Monoisotopic Mass:
128.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties