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81066-14-0 | Methanone, (3-bromo-2-hydroxyphenyl)cyclohexyl-
CAS No: 81066-14-0 Catalog No: AG005HI7 MDL No:
Product Description
Catalog Number:
AG005HI7
Chemical Name:
Methanone, (3-bromo-2-hydroxyphenyl)cyclohexyl-
CAS Number:
81066-14-0
Molecular Formula:
C13H15BrO2
Molecular Weight:
283.1610
IUPAC Name:
(3-bromo-2-hydroxyphenyl)-cyclohexylmethanone
InChI:
InChI=1S/C13H15BrO2/c14-11-8-4-7-10(13(11)16)12(15)9-5-2-1-3-6-9/h4,7-9,16H,1-3,5-6H2
InChI Key:
OEGYYKSFXKTBIA-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1O)Br)C1CCCCC1
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.026g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.165g/mol
Monoisotopic Mass:
282.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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