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1115-56-6 | 5-Bromo-3-methyl-2-pentanone
CAS No: 1115-56-6 Catalog No: AG01FLKR MDL No:
Product Description
Catalog Number:
AG01FLKR
Chemical Name:
5-Bromo-3-methyl-2-pentanone
CAS Number:
1115-56-6
IUPAC Name:
5-bromo-3-methylpentan-2-one
InChI:
InChI=1S/C6H11BrO/c1-5(3-4-7)6(2)8/h5H,3-4H2,1-2H3
InChI Key:
JHVBVETVQZPKDG-UHFFFAOYSA-N
Properties
Complexity:
80.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.999g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.057g/mol
Monoisotopic Mass:
177.999g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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