Home Halogens Ethanone, 1-(3-bromo-2-furanyl)-

Ethanone, 1-(3-bromo-2-furanyl)-

CAS No.:
22037-29-2
Catalog Number:
AG007Q4T
Molecular Formula:
C6H5BrO2
Molecular Weight:
189.0067
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Product Description
Catalog Number:
AG007Q4T
Chemical Name:
Ethanone, 1-(3-bromo-2-furanyl)-
CAS Number:
22037-29-2
Molecular Formula:
C6H5BrO2
Molecular Weight:
189.0067
MDL Number:
MFCD19611108
IUPAC Name:
1-(3-bromofuran-2-yl)ethanone
InChI:
InChI=1S/C6H5BrO2/c1-4(8)6-5(7)2-3-9-6/h2-3H,1H3
InChI Key:
QPZZLTOSEPARRM-UHFFFAOYSA-N
SMILES:
CC(=O)c1occc1Br
Properties
Complexity:
124  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.947g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.008g/mol
Monoisotopic Mass:
187.947g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
A concise synthesis of furostifoline by tetrabutylammonium fluoride-promoted indole ring formation. Chemical & pharmaceutical bulletin 20020101
Properties