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Capillin
[CAS# 495-74-9]

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Identification
Name Capillin
Synonyms 2,4-Hexadiyn-1-One, 1-Phenyl-; Nsc113499; 4-07-00-01354 (Beilstein Handbook Reference)
Molecular Structure CAS#: 495-74-9, Capillin
Molecular Formula C12H8O
Molecular Weight 168.19
CAS Registry Number 495-74-9
SMILES C1=C(C(=O)C#CC#CC)C=CC=C1
InChI 1S/C12H8O/c1-2-3-5-10-12(13)11-8-6-4-7-9-11/h4,6-9H,1H3
InChIKey RAZOKRUZEQERLH-UHFFFAOYSA-N
Properties
Density 1.157g/cm3 (Cal.)
Boiling point 269.911°C at 760 mmHg (Cal.)
Flash point 115.125°C (Cal.)
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