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820243-52-5 | Methanone, (2,4-dibromo-6-hydroxyphenyl)(2-hydroxyphenyl)-
CAS No: 820243-52-5 Catalog No: AG00538I MDL No:
Product Description
Catalog Number:
AG00538I
Chemical Name:
Methanone, (2,4-dibromo-6-hydroxyphenyl)(2-hydroxyphenyl)-
CAS Number:
820243-52-5
Molecular Formula:
C13H8Br2O3
Molecular Weight:
372.0088
IUPAC Name:
(2,4-dibromo-6-hydroxyphenyl)-(2-hydroxyphenyl)methanone
InChI:
InChI=1S/C13H8Br2O3/c14-7-5-9(15)12(11(17)6-7)13(18)8-3-1-2-4-10(8)16/h1-6,16-17H
InChI Key:
CGWJGQFOGCGYAJ-UHFFFAOYSA-N
SMILES:
Brc1cc(O)c(c(c1)Br)C(=O)c1ccccc1O
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
371.882g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
372.012g/mol
Monoisotopic Mass:
369.884g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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