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14527-48-1 | Thiazole, 2-(ethylthio)-
CAS No: 14527-48-1 Catalog No: AG001KQE MDL No:
Product Description
Catalog Number:
AG001KQE
Chemical Name:
Thiazole, 2-(ethylthio)-
CAS Number:
14527-48-1
Molecular Formula:
C5H7NS2
Molecular Weight:
145.2458
IUPAC Name:
2-ethylsulfanyl-1,3-thiazole
InChI:
InChI=1S/C5H7NS2/c1-2-7-5-6-3-4-8-5/h3-4H,2H2,1H3
InChI Key:
XLTNDCQBOHRNPR-UHFFFAOYSA-N
SMILES:
CCSc1nccs1
Properties
Complexity:
67.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.002g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.238g/mol
Monoisotopic Mass:
145.002g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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