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80881-40-9 | Thiazole,2-ethyl-2,5-dihydro-2,4-dimethyl-
CAS No: 80881-40-9 Catalog No: AG005IAQ MDL No:
Product Description
Catalog Number:
AG005IAQ
Chemical Name:
Thiazole,2-ethyl-2,5-dihydro-2,4-dimethyl-
CAS Number:
80881-40-9
Molecular Formula:
C7H13NS
Molecular Weight:
143.2498
IUPAC Name:
2-ethyl-2,4-dimethyl-5H-1,3-thiazole
InChI:
InChI=1S/C7H13NS/c1-4-7(3)8-6(2)5-9-7/h4-5H2,1-3H3
InChI Key:
VDSBMIOHCYMJGU-UHFFFAOYSA-N
SMILES:
CCC1(C)SCC(=N1)C
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.077g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.248g/mol
Monoisotopic Mass:
143.077g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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