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α-Oxo-2-thiopheneacetonitrile

α-Oxo-2-thiopheneacetonitrile structure

CAS No:
6007-78-9
Formula:
C6H3NOS
Chemical Name:
α-Oxo-2-thiopheneacetonitrile
Synonyms:
2-Thiopheneacetonitrile,α-oxo-;2-Thiopheneglyoxylonitrile;α-Oxo-2-thiopheneacetonitrile;2-Thiophenecarbonyl cyanide;2-Thenoyl cyanide;2-Oxo-2-(2-thienyl)acetonitrile

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α-Oxo-2-thiopheneacetonitrile Basic Attributes

Molecular Weight：

137.15912

Exact Mass：

137.16

EC Number：

227-860-1

DSSTox ID：

DTXSID50208796

Characteristics

PSA：

69.1

XLogP3：

1.6

Melting Point：

51.5 °C

Computed Properties

Molecular Weight:137.16
XLogP3:1.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:136.99353489
Monoisotopic Mass:136.99353489
Topological Polar Surface Area:69.1
Heavy Atom Count:9
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of α-Oxo-2-thiopheneacetonitrile

Basic Attributes
Characteristics
Computed Properties

α-Oxo-2-thiopheneacetonitrile

SDS

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