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89861-51-8 | Thiazole, 4-methyl-2-(pentadecylthio)-
CAS No: 89861-51-8 Catalog No: AG003WQU MDL No:
Product Description
Catalog Number:
AG003WQU
Chemical Name:
Thiazole, 4-methyl-2-(pentadecylthio)-
CAS Number:
89861-51-8
Molecular Formula:
C19H35NS2
Molecular Weight:
341.6179
IUPAC Name:
4-methyl-2-pentadecylsulfanyl-1,3-thiazole
InChI:
InChI=1S/C19H35NS2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-19-20-18(2)17-22-19/h17H,3-16H2,1-2H3
InChI Key:
PSOYFIGQSIKASF-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCSc1scc(n1)C
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.221g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.616g/mol
Monoisotopic Mass:
341.221g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.4
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