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4,5,6,7-Tetrahydro-1-benzothiophene-3-carbonitrile
[CAS# 95461-20-4]

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Identification
Name 4,5,6,7-Tetrahydro-1-benzothiophene-3-carbonitrile
Synonyms 1-Benzothiophene-3-carbonitrile, 4,5,6,7-tetrahydro-; 4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile; 4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile
Molecular Structure CAS#: 95461-20-4, 4,5,6,7-Tetrahydro-1-benzothiophene-3-carbonitrile
Molecular Formula C9H9NS
Molecular Weight 163.24
CAS Registry Number 95461-20-4
SMILES N#Cc1c2c(sc1)CCCC2
InChI 1S/C9H9NS/c10-5-7-6-11-9-4-2-1-3-8(7)9/h6H,1-4H2
InChIKey FYOOHGLNAJIWQU-UHFFFAOYSA-N
Properties
Density 1.197g/cm3 (Cal.)
Boiling point 303.026°C at 760 mmHg (Cal.)
Flash point 137.066°C (Cal.)
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