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406947-14-6 | [5-(2-Bromo-phenyl)-furan-2-yl]-methanol
CAS No: 406947-14-6 Catalog No: AG01FC4K MDL No:
Product Description
Catalog Number:
AG01FC4K
Chemical Name:
[5-(2-Bromo-phenyl)-furan-2-yl]-methanol
CAS Number:
406947-14-6
Molecular Formula:
C11H9BrO2
Molecular Weight:
253.0920
IUPAC Name:
[5-(2-bromophenyl)furan-2-yl]methanol
InChI:
InChI=1S/C11H9BrO2/c12-10-4-2-1-3-9(10)11-6-5-8(7-13)14-11/h1-6,13H,7H2
InChI Key:
KYZDPBAGKSAIPK-UHFFFAOYSA-N
SMILES:
OCc1ccc(o1)c1ccccc1Br
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.979g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.095g/mol
Monoisotopic Mass:
251.979g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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