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7295-46-7 | 4-Bromohexanophenone
CAS No: 7295-46-7 Catalog No: AG005D1J MDL No:MFCD00075833
Product Description
Catalog Number:
AG005D1J
Chemical Name:
4-Bromohexanophenone
CAS Number:
7295-46-7
Molecular Formula:
C12H15BrO
Molecular Weight:
255.1509
MDL Number:
MFCD00075833
IUPAC Name:
1-(4-bromophenyl)hexan-1-one
InChI:
InChI=1S/C12H15BrO/c1-2-3-4-5-12(14)10-6-8-11(13)9-7-10/h6-9H,2-5H2,1H3
InChI Key:
MVLMRPWLTMFPJI-UHFFFAOYSA-N
SMILES:
CCC(CCC(=O)c1ccccc1)Br
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.031g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.155g/mol
Monoisotopic Mass:
254.031g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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