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Home Halogens 1-(3-bromophenyl)-2-hydroxyethan-1-one

1-(3-bromophenyl)-2-hydroxyethan-1-one

CAS No.:
4079-51-0
Catalog Number:
AG01ALK5
Molecular Formula:
C8H7BrO2
Molecular Weight:
215.0440
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Product Description
Catalog Number:
AG01ALK5
Chemical Name:
1-(3-bromophenyl)-2-hydroxyethan-1-one
CAS Number:
4079-51-0
Molecular Formula:
C8H7BrO2
Molecular Weight:
215.0440
MDL Number:
MFCD16165854
IUPAC Name:
1-(3-bromophenyl)-2-hydroxyethanone
InChI:
InChI=1S/C8H7BrO2/c9-7-3-1-2-6(4-7)8(11)5-10/h1-4,10H,5H2
InChI Key:
RSWPGWSYMLTIOH-UHFFFAOYSA-N
SMILES:
OCC(=O)c1cccc(c1)Br
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.963g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.046g/mol
Monoisotopic Mass:
213.963g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
(E)-2-[1-(3-Amino-4-chloro-phenyl-imino)eth-yl]-4-bromo-phenol. Acta crystallographica. Section E, Structure reports online 20100401
N'-[1-(5-Bromo-2-hydroxy-phen-yl)ethyl-idene]-3,4,5-trihydroxy-benzohydrazide dimethyl sulfoxide solvate trihydrate. Acta crystallographica. Section E, Structure reports online 20100301
Bis{μ-N'-[1-(5-bromo-2-oxidophen-yl)ethyl-idene]benzene-sulfono-hydrazidato}-κO,N':N;κN:O,N'-bis-[(dimethyl sulfoxide-κO)copper(II)]. Acta crystallographica. Section E, Structure reports online 20080201
(μ-4-Bromo-2-{1-[2-(dimethyl-amino)ethyl-imino]eth-yl}phenolato)bis-[ethyl-zinc(II)]. Acta crystallographica. Section E, Structure reports online 20080101
Properties