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Home > Aldehydes > 918304-66-2
918304-66-2 | 3-Benzofurancarboxaldehyde, 7-bromo-2,3-dihydro-3-phenyl-
CAS No: 918304-66-2 Catalog No: AG006TBW MDL No:
Product Description
Catalog Number:
AG006TBW
Chemical Name:
3-Benzofurancarboxaldehyde, 7-bromo-2,3-dihydro-3-phenyl-
CAS Number:
918304-66-2
Molecular Formula:
C15H11BrO2
Molecular Weight:
303.1506
IUPAC Name:
7-bromo-3-phenyl-2H-1-benzofuran-3-carbaldehyde
InChI:
InChI=1S/C15H11BrO2/c16-13-8-4-7-12-14(13)18-10-15(12,9-17)11-5-2-1-3-6-11/h1-9H,10H2
InChI Key:
JNGQIISMUZLWGM-UHFFFAOYSA-N
SMILES:
O=CC1(COc2c1cccc2Br)c1ccccc1
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.994g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.155g/mol
Monoisotopic Mass:
301.994g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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