Home Halogens Ethanone, 2-bromo-1-cyclobutyl-

Ethanone, 2-bromo-1-cyclobutyl-

CAS No.:
128312-69-6
Catalog Number:
AG000XZK
Molecular Formula:
C6H9BrO
Molecular Weight:
177.0391
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Product Description
Catalog Number:
AG000XZK
Chemical Name:
Ethanone, 2-bromo-1-cyclobutyl-
CAS Number:
128312-69-6
Molecular Formula:
C6H9BrO
Molecular Weight:
177.0391
MDL Number:
MFCD11847541
IUPAC Name:
2-bromo-1-cyclobutylethanone
InChI:
InChI=1S/C6H9BrO/c7-4-6(8)5-2-1-3-5/h5H,1-4H2
InChI Key:
ODPHLRQTQFMNJQ-UHFFFAOYSA-N
SMILES:
BrCC(=O)C1CCC1
Properties
Complexity:
96.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.984g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.041g/mol
Monoisotopic Mass:
175.984g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties