Home Halogens 1-(4-bromophenyl)butan-2-one

1-(4-bromophenyl)butan-2-one

CAS No.:
200064-98-8
Catalog Number:
AG00BJHN
Molecular Formula:
C10H11BrO
Molecular Weight:
227.0977
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Product Description
Catalog Number:
AG00BJHN
Chemical Name:
1-(4-bromophenyl)butan-2-one
CAS Number:
200064-98-8
Molecular Formula:
C10H11BrO
Molecular Weight:
227.0977
MDL Number:
MFCD12153256
IUPAC Name:
1-(4-bromophenyl)butan-2-one
InChI:
InChI=1S/C10H11BrO/c1-2-10(12)7-8-3-5-9(11)6-4-8/h3-6H,2,7H2,1H3
InChI Key:
VEZPNCFTZIKUEO-UHFFFAOYSA-N
SMILES:
CCC(=O)Cc1ccc(cc1)Br
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.999g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.101g/mol
Monoisotopic Mass:
225.999g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties