Home Halogens (3-bromo-1-benzofuran-2-yl)methanol

(3-bromo-1-benzofuran-2-yl)methanol

CAS No.:
1783960-04-2
Catalog Number:
AG01B404
Molecular Formula:
C9H7BrO2
Molecular Weight:
227.0547
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Product Description
Catalog Number:
AG01B404
Chemical Name:
(3-bromo-1-benzofuran-2-yl)methanol
CAS Number:
1783960-04-2
Molecular Formula:
C9H7BrO2
Molecular Weight:
227.0547
MDL Number:
MFCD28613660
IUPAC Name:
(3-bromo-1-benzofuran-2-yl)methanol
InChI:
InChI=1S/C9H7BrO2/c10-9-6-3-1-2-4-7(6)12-8(9)5-11/h1-4,11H,5H2
InChI Key:
WOLMUPDGDOIEEX-UHFFFAOYSA-N
SMILES:
OCc1oc2c(c1Br)cccc2
Properties
Complexity:
163  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
227.057g/mol
Monoisotopic Mass:
225.963g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties