Home Aldehydes 3-Oxetaneacetaldehyde

3-Oxetaneacetaldehyde

CAS No.:
928758-00-3
Catalog Number:
AG00IHDI
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
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Product Description
Catalog Number:
AG00IHDI
Chemical Name:
3-Oxetaneacetaldehyde
CAS Number:
928758-00-3
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
IUPAC Name:
2-(oxetan-3-yl)acetaldehyde
InChI:
InChI=1S/C5H8O2/c6-2-1-5-3-7-4-5/h2,5H,1,3-4H2
InChI Key:
AIFBKSGZBRGQJE-UHFFFAOYSA-N
SMILES:
O=CCC1COC1
Properties
Complexity:
66.5  
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:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties