Home Halogens 3-bromocyclopent-2-en-1-one

3-bromocyclopent-2-en-1-one

CAS No.:
51865-32-8
Catalog Number:
AG01DHZT
Molecular Formula:
C5H5BrO
Molecular Weight:
160.9966
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Product Description
Catalog Number:
AG01DHZT
Chemical Name:
3-bromocyclopent-2-en-1-one
CAS Number:
51865-32-8
Molecular Formula:
C5H5BrO
Molecular Weight:
160.9966
IUPAC Name:
3-bromocyclopent-2-en-1-one
InChI:
InChI=1S/C5H5BrO/c6-4-1-2-5(7)3-4/h3H,1-2H2
InChI Key:
SLILNCISGMCZCQ-UHFFFAOYSA-N
SMILES:
BrC1=CC(=O)CC1
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.952g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.998g/mol
Monoisotopic Mass:
159.952g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Marine pyrrolocarbazoles and analogues: synthesis and kinase inhibition. Marine drugs 20091201
Properties