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207799-29-9 | Naphthalene, 2,6-dibromo-1,5-bis(hexyloxy)-
CAS No: 207799-29-9 Catalog No: AG002J9Q MDL No:
Product Description
Catalog Number:
AG002J9Q
Chemical Name:
Naphthalene, 2,6-dibromo-1,5-bis(hexyloxy)-
CAS Number:
207799-29-9
Molecular Formula:
C22H30Br2O2
Molecular Weight:
486.2804
IUPAC Name:
2,6-dibromo-1,5-dihexoxynaphthalene
InChI:
InChI=1S/C22H30Br2O2/c1-3-5-7-9-15-25-21-17-11-14-20(24)22(18(17)12-13-19(21)23)26-16-10-8-6-4-2/h11-14H,3-10,15-16H2,1-2H3
InChI Key:
PBNXBXCHWZLFLB-UHFFFAOYSA-N
SMILES:
CCCCCCOc1c(Br)ccc2c1ccc(c2OCCCCCC)Br
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
486.059g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
486.288g/mol
Monoisotopic Mass:
484.061g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.2
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