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308528

Sigma-Aldrich

Isovaleronitrile

98%

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About This Item

Linear Formula:
(CH3)2CHCH2CN
CAS Number:
625-28-5
Molecular Weight:
83.13
EC Number:
210-884-1
MDL number:
MFCD00001944
UNSPSC Code:
12352100
PubChem Substance ID:
24858675
NACRES:
NA.22

Quality Level

100

Assay

98%

form

liquid

refractive index

n20/D 1.393 (lit.)

bp

128-130 °C/730 mmHg (lit.)

density

0.795 g/mL at 25 °C (lit.)

SMILES string

CC(C)CC#N

InChI

1S/C5H9N/c1-5(2)3-4-6/h5H,3H2,1-2H3

InChI key

QHDRKFYEGYYIIK-UHFFFAOYSA-N

Related Categories

General description

Isovaleronitrile induced Rhodococcus ATCC 39484 produced a nitrilase.

Application

Isovaleronitrile was used in the synthesis of a new type of nitrilase, arylacetonitrilase by Alcaligenes faecalis JM3 cells.

Pictograms

FlameSkull and crossbones
GHS02,GHS06

Signal Word

Danger

Hazard Classifications

Acute Tox. 3 Oral - Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

82.4 °F - closed cup

Flash Point(C)

28 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

PDSCL

Deleterious substance

FSL

Flammable liquids
Type 2 petroleums
Hazardous rank III
Water insoluble liquid

JAN Code

308528-25G:4.548173132747E12
308528-5G:4.548173132754E12

Certificates of Analysis (COA)

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D E Stevenson et al.
Biotechnology and applied biochemistry, 15(3), 283-302 (1992-06-01)
Rhodococcus ATCC 39484 produced a nitrilase when induced with isovaleronitrile. The enzyme was obtainable pure in milligram amounts, had a subunit Mr of 40 kDa, and demonstrated a substrate-induced activation related to aggregation of subunits to form a 560-kDa complex.
T Nagasawa et al.
European journal of biochemistry, 194(3), 765-772 (1990-12-27)
A new type of nitrilase, arylacetonitrilase, has been purified from isovaleronitrile-induced cells of Alcaligenes faecalis JM3 in four steps. The purity of the enzyme was confirmed by SDS/polyacrylamide gel electrophoresis, ampholyte electrofocusing and double immunodiffusion in agarose. The enzyme has
Ji-Dong Shen et al.
Critical reviews in biotechnology, 41(1), 72-93 (2020-10-14)
Nitrilases are widely distributed in nature and are able to hydrolyze nitriles into their corresponding carboxylic acids and ammonia. In industry, nitrilases have been used as green biocatalysts for the production of high value-added products. To date, biocatalysts are considered

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