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180729-91-3 | 2,2'-Bithiazole, 4,4'-dinonyl-
CAS No: 180729-91-3 Catalog No: AG0022AP MDL No:
Product Description
Catalog Number:
AG0022AP
Chemical Name:
2,2'-Bithiazole, 4,4'-dinonyl-
CAS Number:
180729-91-3
Molecular Formula:
C24H40N2S2
Molecular Weight:
420.7178
IUPAC Name:
4-nonyl-2-(4-nonyl-1,3-thiazol-2-yl)-1,3-thiazole
InChI:
InChI=1S/C24H40N2S2/c1-3-5-7-9-11-13-15-17-21-19-27-23(25-21)24-26-22(20-28-24)18-16-14-12-10-8-6-4-2/h19-20H,3-18H2,1-2H3
InChI Key:
FNAZWICXOXNWDC-UHFFFAOYSA-N
SMILES:
CCCCCCCCCc1csc(n1)c1scc(n1)CCCCCCCCC
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
420.263g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
420.718g/mol
Monoisotopic Mass:
420.263g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.6
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