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126369-25-3 | Phenol, 4,4'-ethylidenebis[2,6-dibromo-
CAS No: 126369-25-3 Catalog No: AG000SQ2 MDL No:
Product Description
Catalog Number:
AG000SQ2
Chemical Name:
Phenol, 4,4'-ethylidenebis[2,6-dibromo-
CAS Number:
126369-25-3
Molecular Formula:
C14H10Br4O2
Molecular Weight:
529.8440
IUPAC Name:
2,6-dibromo-4-[1-(3,5-dibromo-4-hydroxyphenyl)ethyl]phenol
InChI:
InChI=1S/C14H10Br4O2/c1-6(7-2-9(15)13(19)10(16)3-7)8-4-11(17)14(20)12(18)5-8/h2-6,19-20H,1H3
InChI Key:
WFQDPXQJWBLPPU-UHFFFAOYSA-N
SMILES:
CC(c1cc(Br)c(c(c1)Br)O)c1cc(Br)c(c(c1)Br)O
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
529.737g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
529.848g/mol
Monoisotopic Mass:
525.741g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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