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765277-78-9 | Thiazole, 5-iodo-2-(5-octyl-2-thienyl)-
CAS No: 765277-78-9 Catalog No: AG005KRC MDL No:
Product Description
Catalog Number:
AG005KRC
Chemical Name:
Thiazole, 5-iodo-2-(5-octyl-2-thienyl)-
CAS Number:
765277-78-9
Molecular Formula:
C15H20INS2
Molecular Weight:
405.3605
IUPAC Name:
5-iodo-2-(5-octylthiophen-2-yl)-1,3-thiazole
InChI:
InChI=1S/C15H20INS2/c1-2-3-4-5-6-7-8-12-9-10-13(18-12)15-17-11-14(16)19-15/h9-11H,2-8H2,1H3
InChI Key:
GBOBESKKRIAUNA-UHFFFAOYSA-N
SMILES:
CCCCCCCCc1ccc(s1)c1ncc(s1)I
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
405.008g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
405.356g/mol
Monoisotopic Mass:
405.008g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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