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87025-10-3 | Phenol, 3,5-dibromo-2,4,6-trimethyl-
CAS No: 87025-10-3 Catalog No: AG004GNH MDL No:
Product Description
Catalog Number:
AG004GNH
Chemical Name:
Phenol, 3,5-dibromo-2,4,6-trimethyl-
CAS Number:
87025-10-3
Molecular Formula:
C9H10Br2O
Molecular Weight:
293.9831
IUPAC Name:
3,5-dibromo-2,4,6-trimethylphenol
InChI:
InChI=1S/C9H10Br2O/c1-4-7(10)5(2)9(12)6(3)8(4)11/h12H,1-3H3
InChI Key:
DEMXNIAFOAEFSU-UHFFFAOYSA-N
SMILES:
Cc1c(O)c(C)c(c(c1Br)C)Br
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.908g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.986g/mol
Monoisotopic Mass:
291.91g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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