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1634-53-3 | Ethanone, 2-bromo-1-(5-methyl-2-furanyl)-
CAS No: 1634-53-3 Catalog No: AG001U34 MDL No:MFCD09261158
Product Description
Catalog Number:
AG001U34
Chemical Name:
Ethanone, 2-bromo-1-(5-methyl-2-furanyl)-
CAS Number:
1634-53-3
Molecular Formula:
C7H7BrO2
Molecular Weight:
203.0333
MDL Number:
MFCD09261158
IUPAC Name:
2-bromo-1-(5-methylfuran-2-yl)ethanone
InChI:
InChI=1S/C7H7BrO2/c1-5-2-3-7(10-5)6(9)4-8/h2-3H,4H2,1H3
InChI Key:
TWJPAIWNJRAWKH-UHFFFAOYSA-N
SMILES:
Cc1ccc(o1)C(=O)CBr
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.963g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.035g/mol
Monoisotopic Mass:
201.963g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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