Home Aldehydes 3,3-dimethyloxirane-2-carbaldehyde

3,3-dimethyloxirane-2-carbaldehyde

CAS No.:
5369-62-0
Catalog Number:
AG01B5RR
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
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Product Description
Catalog Number:
AG01B5RR
Chemical Name:
3,3-dimethyloxirane-2-carbaldehyde
CAS Number:
5369-62-0
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
MDL Number:
MFCD24673793
IUPAC Name:
3,3-dimethyloxirane-2-carbaldehyde
InChI:
InChI=1S/C5H8O2/c1-5(2)4(3-6)7-5/h3-4H,1-2H3
InChI Key:
GLZFKAYNZITDIA-UHFFFAOYSA-N
SMILES:
O=CC1OC1(C)C
Properties
Complexity:
96.3  
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:
1  
Topological Polar Surface Area:
29.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties