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Home >> Chemical Listing >> Page 590 >> 1-[(2-Thioxo-1-Pyrrolidinyl)Methyl]-2-Azepanone

1-[(2-Thioxo-1-Pyrrolidinyl)Methyl]-2-Azepanone
[CAS# 157439-35-5]

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Identification
Name 1-[(2-Thioxo-1-Pyrrolidinyl)Methyl]-2-Azepanone
Synonyms 1-((2-thioxopyrrolidin-1-yl)methyl)azepan-2-one
Molecular Structure CAS#: 157439-35-5, 1-[(2-Thioxo-1-Pyrrolidinyl)Methyl]-2-Azepanone
Molecular Formula C11H18N2OS
Molecular Weight 226.34
CAS Registry Number 157439-35-5
SMILES C1CCC(=O)N(CC1)CN2CCCC2=S
InChI 1S/C11H18N2OS/c14-10-5-2-1-3-7-12(10)9-13-8-4-6-11(13)15/h1-9H2
InChIKey OMWUDVIYOWEQSJ-UHFFFAOYSA-N
Properties
Density 1.202g/cm3 (Cal.)
Boiling point 390.31°C at 760 mmHg (Cal.)
Flash point 189.853°C (Cal.)
Refractive index 1.594 (Cal.)
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