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40018-25-5

40018-25-5 Structure

40018-25-5 Structure
IdentificationMore
[Name]

2-CHLOROBENZOYLACETONITRILE
[CAS]

40018-25-5
[Synonyms]

2-CHLOROBENZOYLACETONITRILE
3-(2'-CHLOROPHENYL)-3-OXOPROPANENITRILE
3-(2-CHLOROPHENYL)-3-OXOPROPANENITRILE
3-(2-CHLORO-PHENYL)-3-OXO-PROPIONITRILE
2-Chlorobenzoylacetonitrile, 99+%
2-Chlorobenzoylacetonitrile,98%
O-CHLOROBENZOYLACETONITRILE
[EINECS(EC#)]

609-772-9
[Molecular Formula]

C9H6ClNO
[MDL Number]

MFCD00051624
[Molecular Weight]

179.6
[MOL File]

40018-25-5.mol
Chemical PropertiesBack Directory
[Appearance]

Yellowish Solid
[Melting point ]

55-59 °C
[Boiling point ]

302.2±22.0 °C(Predicted)
[density ]

1.2364 (rough estimate)
[refractive index ]

1.5330 (estimate)
[storage temp. ]

Sealed in dry,Store in freezer, under -20°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

6.41±0.10(Predicted)
[color ]

Yellow to Dark Yellow
[Sensitive ]

Moisture Sensitive
[BRN ]

2413204
[CAS DataBase Reference]

40018-25-5(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn,T,Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S22:Do not breathe dust .
[RIDADR ]

3276
[PackingGroup ]

III
[HS Code ]

29269095
Hazard InformationBack Directory
[Chemical Properties]

Yellowish Solid
[Uses]

2-Chlorobenzoylacetonitrile is used in the synthesis of Clotiazepam (C587410). Compound commonly found in brown and black hair dyes.
Spectrum DetailBack Directory
[Spectrum Detail]

2-CHLOROBENZOYLACETONITRILE(40018-25-5)MS
2-CHLOROBENZOYLACETONITRILE(40018-25-5)IR1
2-CHLOROBENZOYLACETONITRILE(40018-25-5)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Chlorobenzoylacetonitrile, 98%(40018-25-5)
[Alfa Aesar]

2-Chlorobenzoylacetonitrile, 98%(40018-25-5)
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