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128424-48-6 | Benzene, 1,4-dibromo-2,5-bis(3-methylbutoxy)-
CAS No: 128424-48-6 Catalog No: AG000Y2T MDL No:
Product Description
Catalog Number:
AG000Y2T
Chemical Name:
Benzene, 1,4-dibromo-2,5-bis(3-methylbutoxy)-
CAS Number:
128424-48-6
Molecular Formula:
C16H24Br2O2
Molecular Weight:
408.1686
IUPAC Name:
1,4-dibromo-2,5-bis(3-methylbutoxy)benzene
InChI:
InChI=1S/C16H24Br2O2/c1-11(2)5-7-19-15-9-14(18)16(10-13(15)17)20-8-6-12(3)4/h9-12H,5-8H2,1-4H3
InChI Key:
NJXRCCALWJCZGY-UHFFFAOYSA-N
SMILES:
CC(CCOc1cc(Br)c(cc1Br)OCCC(C)C)C
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
408.012g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
408.174g/mol
Monoisotopic Mass:
406.014g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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