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94613-56-6 | Thiazole, 2-(dodecyldithio)-4,5-dihydro-
CAS No: 94613-56-6 Catalog No: AG0069FH MDL No:
Product Description
Catalog Number:
AG0069FH
Chemical Name:
Thiazole, 2-(dodecyldithio)-4,5-dihydro-
CAS Number:
94613-56-6
Molecular Formula:
C15H29NS3
Molecular Weight:
319.5925
IUPAC Name:
2-(dodecyldisulfanyl)-4,5-dihydro-1,3-thiazole
InChI:
InChI=1S/C15H29NS3/c1-2-3-4-5-6-7-8-9-10-11-13-18-19-15-16-12-14-17-15/h2-14H2,1H3
InChI Key:
FFKLCJQSAMRJPP-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCSSC1=NCCS1
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.146g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.584g/mol
Monoisotopic Mass:
319.146g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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