Home Halogens 2-Hexanone, 6-bromo-

2-Hexanone, 6-bromo-

CAS No.:
10226-29-6
Catalog Number:
AG00072I
Molecular Formula:
C6H11BrO
Molecular Weight:
179.0549
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Product Description
Catalog Number:
AG00072I
Chemical Name:
2-Hexanone, 6-bromo-
CAS Number:
10226-29-6
Molecular Formula:
C6H11BrO
Molecular Weight:
179.0549
MDL Number:
MFCD00044891
IUPAC Name:
6-bromohexan-2-one
InChI:
InChI=1S/C6H11BrO/c1-6(8)4-2-3-5-7/h2-5H2,1H3
InChI Key:
CZGOECYPTLSLNI-UHFFFAOYSA-N
SMILES:
BrCCCCC(=O)C
EC Number:
233-544-4
Properties
Complexity:
70.9  
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:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties