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77023-10-0 | 7-Oxabicyclo[4.1.0]heptane-1-carboxaldehyde, 3,4-dibromo-
CAS No: 77023-10-0 Catalog No: AG00573K MDL No:
Product Description
Catalog Number:
AG00573K
Chemical Name:
7-Oxabicyclo[4.1.0]heptane-1-carboxaldehyde, 3,4-dibromo-
CAS Number:
77023-10-0
Molecular Formula:
C7H8Br2O2
Molecular Weight:
283.9452
IUPAC Name:
3,4-dibromo-7-oxabicyclo[4.1.0]heptane-1-carbaldehyde
InChI:
InChI=1S/C7H8Br2O2/c8-4-1-6-7(3-10,11-6)2-5(4)9/h3-6H,1-2H2
InChI Key:
IWHOFISHSWRMGU-UHFFFAOYSA-N
SMILES:
O=CC12CC(Br)C(CC2O1)Br
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.887g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.947g/mol
Monoisotopic Mass:
281.889g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.6A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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