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C94807

Sigma-Aldrich

3-Pyridinecarbonitrile

98%

Synonym(s):

3-Cyanopyridine, Nicotinic acid nitrile, Nicotinonitrile

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About This Item

Empirical Formula (Hill Notation):
C6H4N2
CAS Number:
100-54-9
Molecular Weight:
104.11
Beilstein:
107711
EC Number:
202-863-0
MDL number:
MFCD00006372
UNSPSC Code:
12352100
PubChem Substance ID:
24893001
NACRES:
NA.22

Quality Level

100

Assay

98%

form

crystals

impurities

<2.5% acetone

bp

201 °C (lit.)

mp

48-52 °C (lit.)

SMILES string

N#Cc1cccnc1

InChI

1S/C6H4N2/c7-4-6-2-1-3-8-5-6/h1-3,5H

InChI key

GZPHSAQLYPIAIN-UHFFFAOYSA-N

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Related Categories

Pictograms

CorrosionExclamation mark
GHS05,GHS07

Signal Word

Danger

Hazard Statements

H302,H315,H318

Hazard Classifications

Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

190.4 °F

Flash Point(C)

88 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Yao Yang et al.
Biodegradation, 21(4), 593-602 (2010-02-02)
A nicotinate dehydrogenase (NaDH) gene cluster was cloned from Comamonas testosteroni JA1. The enzyme, termed NaDH(JA1), is composed of 21, 82, and 46 kDa subunits, respectivley containing [2Fe2S], Mo(V) and cytochrome c domains. The recombinant NaDH(JA1) can catalyze the hydroxylation
Li-Qun Jin et al.
New biotechnology, 28(6), 610-615 (2011-05-10)
2-Chloronicotinic acid is receiving much attention for its effective applications as a key precursor in the synthesis of pesticides and medicines. In this study, a strain ZJB-09149 converting 2-chloro-3-cyanopyridine to 2-chloronicotinic acid was newly isolated and identified as Rhodococcus erythropolis
Haiyang Fan et al.
Bioprocess and biosystems engineering, 40(8), 1271-1281 (2017-06-07)
A novel aliphatic nitrilase, REH16, was found in Ralstonia eutropha H16 and overexpressed in Escherichia coli BL21(DE3), and its enzymatic properties were studied. The temperature and pH optima were 37 °C and 6.6, respectively, and the best thermostability of the nitrilase
Win-Long Chia et al.
International journal of molecular sciences, 14(9), 18809-18823 (2013-09-17)
A new series of teraryl 2-(4'-alkoxybiphen-4-yl)-5-cyanopyridines (nO-PPPyCN, n = 2-8) compounds, bearing a cyanopyridine terminus, were synthesized using a short 2-step reaction with overall yields between 33% and 69%. Spectral analyses were in accord with the expected structures. Thermotropic behavior
Zhongyi Cheng et al.
Molecules (Basel, Switzerland), 25(20) (2020-10-23)
High thermostability and catalytic activity are key properties for nitrile hydratase (NHase, EC 4.2.1.84) as a well-industrialized catalyst. In this study, rational design was applied to tailor the thermostability of NHase from Pseudonocardia thermophila JCM3095 (PtNHase) by combining FireProt server
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