1-(2,4-Dimethyl-5-thiazolyl)-2-hydroxyethanone - CAS 122229-24-7
Catalog: |
BB005366 |
Product Name: |
1-(2,4-Dimethyl-5-thiazolyl)-2-hydroxyethanone |
CAS: |
122229-24-7 |
Synonyms: |
1-(2,4-dimethyl-5-thiazolyl)-2-hydroxyethanone; 1-(2,4-dimethyl-1,3-thiazol-5-yl)-2-hydroxyethanone |
IUPAC Name: | 1-(2,4-dimethyl-1,3-thiazol-5-yl)-2-hydroxyethanone |
Description: | 1-(2,4-Dimethyl-5-thiazolyl)-2-hydroxyethanone (CAS# 122229-24-7 ) is a useful research chemical. |
Molecular Weight: | 171.22 |
Molecular Formula: | C7H9NO2S |
Canonical SMILES: | CC1=C(SC(=N1)C)C(=O)CO |
InChI: | InChI=1S/C7H9NO2S/c1-4-7(6(10)3-9)11-5(2)8-4/h9H,3H2,1-2H3 |
InChI Key: | NKKJQQKQXVTXDC-UHFFFAOYSA-N |
LogP: | 0.93490 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.0353997 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.0353997 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 78.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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