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19961-53-6 | Thiazole, 2-ethyl-5-methyl-
CAS No: 19961-53-6 Catalog No: AG002C8B MDL No:
Product Description
Catalog Number:
AG002C8B
Chemical Name:
Thiazole, 2-ethyl-5-methyl-
CAS Number:
19961-53-6
Molecular Formula:
C6H9NS
Molecular Weight:
127.2074
IUPAC Name:
2-ethyl-5-methyl-1,3-thiazole
InChI:
InChI=1S/C6H9NS/c1-3-6-7-4-5(2)8-6/h4H,3H2,1-2H3
InChI Key:
YXWWUNNKMJZIOW-UHFFFAOYSA-N
SMILES:
CCc1ncc(s1)C
Properties
Complexity:
74.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.046g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.205g/mol
Monoisotopic Mass:
127.046g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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