octyl 4,6-dibromo-3-fluorothieno[2,3-c]thiophene-2-carboxylate


Chemical Name: octyl 4,6-dibromo-3-fluorothieno[2,3-c]thiophene-2-carboxylate
CAS Number: 1160823-76-6
Product Number: AG000BKL(AGN-PC-0CB6ZX)
Synonyms:
MDL No:
Molecular Formula: C15H17Br2FO2S2
Molecular Weight: 472.2307

Identification/Properties


Computed Properties
Molecular Weight:
472.225g/mol
XLogP3:
8.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
9
Exact Mass:
471.9g/mol
Monoisotopic Mass:
469.902g/mol
Topological Polar Surface Area:
82.8A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
376
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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