Thiocyanic acid, pentyl ester
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Thiocyanic acid, pentyl ester
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CAS No:
32446-40-5
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Formula:
C6H11NS
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Chemical Name:
Thiocyanic acid, pentyl ester
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Synonyms:
Thiocyanic acid,pentyl ester;Pentane,1-thiocyanato-;Amyl thiocyanate;Pentyl thiocyanate;n-Pentyl thiocyanate;1-Thiocyanatopentane
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CAS No:
Characteristics
49.1 Ų
0.9412 g/cm3 @ Temp: 25 °C
90-91 °C @ Press: 16 Torr
1.5500 (estimate)
LD50 ipr-mus: 75 mg/kg JACSAT 78,3843,56
Computed Properties
Molecular Weight:129.23
XLogP3:2.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:129.06122053
Monoisotopic Mass:129.06122053
Topological Polar Surface Area:49.1
Heavy Atom Count:8
Complexity:81.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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