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20895-05-0 | 1-Propanone, 2-bromo-1-(2-furanyl)-2-methyl-
CAS No: 20895-05-0 Catalog No: AG002JZO MDL No:MFCD13173355
Product Description
Catalog Number:
AG002JZO
Chemical Name:
1-Propanone, 2-bromo-1-(2-furanyl)-2-methyl-
CAS Number:
20895-05-0
Molecular Formula:
C8H9BrO2
Molecular Weight:
217.0599
MDL Number:
MFCD13173355
IUPAC Name:
2-bromo-1-(furan-2-yl)-2-methylpropan-1-one
InChI:
InChI=1S/C8H9BrO2/c1-8(2,9)7(10)6-4-3-5-11-6/h3-5H,1-2H3
InChI Key:
PAVMHPGRJHSFCL-UHFFFAOYSA-N
SMILES:
O=C(C(Br)(C)C)c1ccco1
NSC Number:
154712
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.979g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.062g/mol
Monoisotopic Mass:
215.979g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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