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Structure

2-Nitrothiophene-4-carbonitrile

CAS
42137-23-5
Catalog Number
ACM42137235
Category
Other Products
Molecular Weight
154.15
Molecular Formula
C5H2N2O2S

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Specification

Synonyms
2-Nitrothiophene-4-carbonitrile, 5-nitrothiophene-3-carbonitrile, 42137-23-5, 5-Nitro-3-thiophenecarbonitrile, ST50411451, ZINC00143162, ACMC-1AOGV, AC1L3LEF, Maybridge1_003117, 4-Cyano-2-nitrothiophene, SureCN9168884, SureCN10773774, CTK1D6461, HMS550F15, NACMZLGGHMPMKQ-UHFFFAOYSA-, MolPort-000-144-298, SBB086992, AKOS009158333, AG-A-86775, AG-L-64251
IUPAC Name
5-nitrothiophene-3-carbonitrile
Canonical SMILES
C1=C(SC=C1C#N)[N+](=O)[O-]
InChI Key
NACMZLGGHMPMKQ-UHFFFAOYSA-N
Boiling Point
276.1ºC at 760 mmHg
Melting Point
121ºC
Flash Point
120.8ºC
Density
1.5g/cm³
Exact Mass
153.98400
Hazard Statements
Xn:Harmful;
H-Bond Acceptor
4
H-Bond Donor
0
Packing Group
III
Safety Description
S22-S36/37
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