125954

Dichloroacetonitrile

98%

Manufacturer: Sigma Aldrich

CAS Number: 3018-12-0

Synonym(S): 2,2-Dichloroacetonitrile, Dichloromethyl cyanide

Select a Size

Pack Size SKU Availability Price
25 G 125954-25-G In Stock ₹ 4,806.30

125954 - 25 G

₹ 4,806.30

In Stock

Quantity

1

Base Price: ₹ 4,806.30

GST (18%): ₹ 865.134

Total Price: ₹ 5,671.434

Quality Level

100

Assay

98%

form

liquid

refractive index

n20/D 1.44 (lit.)

bp

110-112 °C (lit.)

density

1.369 g/mL at 25 °C (lit.)

SMILES string

ClC(Cl)C#N

InChI

1S/C2HCl2N/c3-2(4)1-5/h2H

InChI key

STZZWJCGRKXEFF-UHFFFAOYSA-N

Other Options

Image Product Name Manufacturer Price Range
AB72651
3018-12-0 | Dichloroacetonitrile
A2B Chem ₹ 3,251.28 - ₹ 64,255.56

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Description

  • Application: Dichloroacetonitrile can be used as a reactant to prepare: Chiral α, α-dichloro-β-aminonitriles via Pd-catalyzed enantioselective Mannich-type reaction with imines.[1]α, α-dialkyl-substituted nitriles by an alkylation reaction with trialkylboranes in the presence of phenoxide base as a base.[2] Halogenated pyridines via copper-catalyzed reaction with methacrolein.[2] α,α-dichloro-β-hydroxy nitriles by condensation reaction with aldehydes and ketones in the presence of an alkoxide base.[2]Selenium heterocycle derivatives via Diels–Alder cyclization with selenoaldehydes.[2]Dichloroacetonitrile can also be used to develop an efficient method for the extraction and determination of common volatile halogenated disinfection by-products using the static headspace technique coupled with gas chromatography-mass spectrometry.[3]
  • Biochem/physiol Actions: Dichloroacetonitrile is direct-acting mutagen and induces DNA strand breaks in cultured human lymphoblastic cells. It induces apoptosis or necrosis in murine macrophage cell line via reactive oxygen intermediates-mediated oxidative mechanisms of cellular damage[4].

SAFETY INFORMATION

Pictograms

GHS02,GHS05,GHS07

Signal Word

Danger

Hazard Statements

H226,H302,H314

Precautionary Statements

P210 - P233 - P280 - P301 + P312 - P303 + P361 + P353 - P305 + P351 + P338

Hazard Classifications

Acute Tox. 4 Oral - Flam. Liq. 3 - Skin Corr. 1B

WGK

WGK 3

Flash Point(F)

closed cup

Flash Point(C)

closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Quality Level:
100

Assay:
98%

form:
liquid

refractive index:
n20/D 1.44 (lit.)

bp:
110-112 °C (lit.)

density:
1.369 g/mL at 25 °C (lit.)

SMILES string:
ClC(Cl)C#N

InChI:
1S/C2HCl2N/c3-2(4)1-5/h2H

InChI key:
STZZWJCGRKXEFF-UHFFFAOYSA-N

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form:
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refractive index:
__

bp:
__

density:
__

SMILES string:
__

InChI:
1S/C20H22O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7-8,12,17-18,21-22H,4,6,9-11H2,2H3/t17-,18+,19+,20+/m1/s1

InChI key:
DUZHXWCAIBMQPI-FYQPLNBISA-N

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powder or crystals

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__

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__

density:
__

SMILES string:
__

InChI:
__

InChI key:
__

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Sigma Aldrich

12602

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Quality Level:
200

Assay:
99.5-101.0% (acidimetric)

form:
powder or crystals

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__

bp:
__

density:
__

SMILES string:
__

InChI:
__

InChI key:
__