Thiophene, 2-butyl- - CAS 1455-20-5
Catalog: |
BB053738 |
Product Name: |
Thiophene, 2-butyl- |
CAS: |
1455-20-5 |
Synonyms: |
2-n-Butylthiophene |
IUPAC Name: | 2-butylthiophene |
Molecular Weight: | 140.25 |
Molecular Formula: | C8H12S |
Canonical SMILES: | CCCCC1=CC=CS1 |
InChI: | InChI=1S/C8H12S/c1-2-3-5-8-6-4-7-9-8/h4,6-7H,2-3,5H2,1H3 |
InChI Key: | MNDZHERKKXUTOE-UHFFFAOYSA-N |
Boiling Point: | 181.0±3.0 °C at 760 mmHg |
Purity: | 95% |
Density: | 1.0±0.1 g/cm3 |
Appearance: | Colorless Liquid |
Complexity: | 71 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 140.06597156 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 140.06597156 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 28.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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