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Home > Aldehydes > 281678-73-7
281678-73-7 | 5-BROMO-2,3-DIHYDROBENZO[B]FURAN-7-CARBALDEHYDE
CAS No: 281678-73-7 Catalog No: AG00BDP2 MDL No:MFCD06200892
Product Description
Catalog Number:
AG00BDP2
Chemical Name:
5-BROMO-2,3-DIHYDROBENZO[B]FURAN-7-CARBALDEHYDE
CAS Number:
281678-73-7
Molecular Formula:
C9H7BrO2
Molecular Weight:
227.0547
MDL Number:
MFCD06200892
IUPAC Name:
5-bromo-2,3-dihydro-1-benzofuran-7-carbaldehyde
InChI:
InChI=1S/C9H7BrO2/c10-8-3-6-1-2-12-9(6)7(4-8)5-11/h3-5H,1-2H2
InChI Key:
LQCBHNHULMHKFB-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Br)cc2c1OCC2
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.963g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.057g/mol
Monoisotopic Mass:
225.963g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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