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104256-96-4 | Thiazole, 2-ethyl-4-methyl-5-propyl-
CAS No: 104256-96-4 Catalog No: AG007I7L MDL No:
Product Description
Catalog Number:
AG007I7L
Chemical Name:
Thiazole, 2-ethyl-4-methyl-5-propyl-
CAS Number:
104256-96-4
Molecular Formula:
C9H15NS
Molecular Weight:
169.2871
IUPAC Name:
2-ethyl-4-methyl-5-propyl-1,3-thiazole
InChI:
InChI=1S/C9H15NS/c1-4-6-8-7(3)10-9(5-2)11-8/h4-6H2,1-3H3
InChI Key:
SRVOSKQWHYHPGF-UHFFFAOYSA-N
SMILES:
CCCc1sc(nc1C)CC
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.093g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.286g/mol
Monoisotopic Mass:
169.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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