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1-[5-(1-Pentyn-1-yl)-2-thienyl]ethanone
[CAS# 662138-54-7]

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Identification
Name 1-[5-(1-Pentyn-1-yl)-2-thienyl]ethanone
Synonyms 1-(5-pent-1-ynyl-2-thienyl)ethan-1-one; ZINC02383417
Molecular Structure CAS#: 662138-54-7, 1-[5-(1-Pentyn-1-yl)-2-thienyl]ethanone
Molecular Formula C11H12OS
Molecular Weight 192.28
CAS Registry Number 662138-54-7
SMILES O=C(c1sc(C#CCCC)cc1)C
InChI 1S/C11H12OS/c1-3-4-5-6-10-7-8-11(13-10)9(2)12/h7-8H,3-4H2,1-2H3
InChIKey NMBCFLIWEQESRN-UHFFFAOYSA-N
Properties
Density 1.098g/cm3 (Cal.)
Boiling point 328.934°C at 760 mmHg (Cal.)
Flash point 152.734°C (Cal.)
Refractive index 1.546 (Cal.)
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