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Home >> Chemical Listing >> Page 153 >> 1-(3-Pyridinyl)-3-Butyn-1-One

1-(3-Pyridinyl)-3-Butyn-1-One
[CAS# 113590-54-8]

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Identification
Name 1-(3-Pyridinyl)-3-Butyn-1-One
Synonyms 1-(pyridin-3-yl)but-3-yn-1-one; 3-Butyn-1-one,1-(3-pyridinyl)-
Molecular Structure CAS#: 113590-54-8, 1-(3-Pyridinyl)-3-Butyn-1-One
Molecular Formula C9H7NO
Molecular Weight 145.16
CAS Registry Number 113590-54-8
SMILES O=C(CC#C)c1cccnc1
InChI 1S/C9H7NO/c1-2-4-9(11)8-5-3-6-10-7-8/h1,3,5-7H,4H2
InChIKey QUHBKADGOFVMAT-UHFFFAOYSA-N
Properties
Density 1.108g/cm3 (Cal.)
Boiling point 278.474°C at 760 mmHg (Cal.)
Flash point 129.648°C (Cal.)
Refractive index 1.545 (Cal.)
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