Home Aldehydes 1-methyl-2-oxabicyclo[2.1.1]hexane-4-carbaldehyde

1-methyl-2-oxabicyclo[2.1.1]hexane-4-carbaldehyde

CAS No.:
2137762-49-1
Catalog Number:
AG01EMUT
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
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Product Description
Catalog Number:
AG01EMUT
Chemical Name:
1-methyl-2-oxabicyclo[2.1.1]hexane-4-carbaldehyde
CAS Number:
2137762-49-1
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
MDL Number:
MFCD31601397
IUPAC Name:
1-methyl-2-oxabicyclo[2.1.1]hexane-4-carbaldehyde
InChI:
InChI=1S/C7H10O2/c1-6-2-7(3-6,4-8)5-9-6/h4H,2-3,5H2,1H3
InChI Key:
ABSRPJCTVFTGML-UHFFFAOYSA-N
SMILES:
O=CC12COC(C1)(C2)C
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties