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Home >> Chemical Listing >> Page 2985 >> Phenyl(2-thioxo-1-azepanyl)methanone

Phenyl(2-thioxo-1-azepanyl)methanone
[CAS# 909553-96-4]

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Identification
Name Phenyl(2-thioxo-1-azepanyl)methanone
Synonyms phenyl(2-thioxoazepan-1-yl)methanone
Molecular Structure CAS#: 909553-96-4, Phenyl(2-thioxo-1-azepanyl)methanone
Molecular Formula C13H15NOS
Molecular Weight 233.33
CAS Registry Number 909553-96-4
SMILES O=C(c1ccccc1)N2C(=S)CCCCC2
InChI 1S/C13H15NOS/c15-13(11-7-3-1-4-8-11)14-10-6-2-5-9-12(14)16/h1,3-4,7-8H,2,5-6,9-10H2
InChIKey MWPAIMCVIFSFGH-UHFFFAOYSA-N
Properties
Density 1.196g/cm3 (Cal.)
Boiling point 351.541°C at 760 mmHg (Cal.)
Flash point 166.406°C (Cal.)
Refractive index 1.616 (Cal.)
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