2-Methyl-1-(thiophen-2-yl)propan-1-one - CAS 36448-60-9
Catalog: |
BB046835 |
Product Name: |
2-Methyl-1-(thiophen-2-yl)propan-1-one |
CAS: |
36448-60-9 |
Synonyms: |
2-methyl-1-thien-2-ylpropan-1-one; 2-Methyl-1-(2-thienyl)-1-propanone; 2-methyl-1-(2-thienyl)propan-1-one |
IUPAC Name: | 2-methyl-1-thiophen-2-ylpropan-1-one |
Description: | 2-Methyl-1-(thiophen-2-yl)propan-1-one (CAS# 36448-60-9 ) is a useful research chemical. |
Molecular Weight: | 154.23 |
Molecular Formula: | C8H10OS |
Canonical SMILES: | CC(C)C(=O)C1=CC=CS1 |
InChI: | InChI=1S/C8H10OS/c1-6(2)8(9)7-4-3-5-10-7/h3-6H,1-2H3 |
InChI Key: | OTQCCAKDOPROBT-UHFFFAOYSA-N |
Boiling Point: | 238 ℃ at 760 mmHg |
Purity: | ≥ 95 % |
Density: | 1.072 g/cm3 |
Complexity: | 131 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.04523611 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.04523611 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 45.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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