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17764-92-0 | 1-Propanone, 1-(4-bromo-2-hydroxyphenyl)-
CAS No: 17764-92-0 Catalog No: AG0025FK MDL No:MFCD03791251
Product Description
Catalog Number:
AG0025FK
Chemical Name:
1-Propanone, 1-(4-bromo-2-hydroxyphenyl)-
CAS Number:
17764-92-0
Molecular Formula:
C9H9BrO2
Molecular Weight:
229.0706
MDL Number:
MFCD03791251
IUPAC Name:
1-(4-bromo-2-hydroxyphenyl)propan-1-one
InChI:
InChI=1S/C9H9BrO2/c1-2-8(11)7-4-3-6(10)5-9(7)12/h3-5,12H,2H2,1H3
InChI Key:
CPZPNEVIZAJTDT-UHFFFAOYSA-N
SMILES:
CCC(=O)c1ccc(cc1O)Br
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.979g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.073g/mol
Monoisotopic Mass:
227.979g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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