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2,2-dibromo-2-chloro-acetonitrile

2,2-dibromo-2-chloro-acetonitrile structure

CAS No:
144772-39-4
Formula:
C2Br2ClN
Chemical Name:
2,2-dibromo-2-chloro-acetonitrile
Synonyms:
Dibromochloroacetonitrile;Acetonitrile,2,2-dibromo-2-chloro-;2,2-dibromo-2-chloroacetonitrile;dibromo(chloro)acetonitrile;ACMC-20n4a1;Acetonitrile, dibromochloro-;DTXSID9021556;SCHEMBL11755000;CTK4C4205;ZINC32192139

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2,2-dibromo-2-chloro-acetonitrile Basic Attributes

Molecular Weight：

233.287

Exact Mass：

230.808594

UNII：

HPU8B5UQ4C

DSSTox ID：

DTXSID9021556

Characteristics

PSA：

23.8

XLogP3：

2.86

Density：

2.515±0.06 g/cm3(Predicted)

Boiling Point：

118.2±35.0 °C(Predicted)

Flash Point：

25.3±25.9 °C

Refractive Index：

1.595

Vapor Pressure：

16.8mmHg at 25°C

2,2-dibromo-2-chloro-acetonitrile Use and Manufacturing

Disinfection byproducts (DBPs) produced in the chlorination or chloramination of drinking water.

Computed Properties

Molecular Weight:233.29
XLogP3:2.2
Hydrogen Bond Acceptor Count:1
Exact Mass:232.80655
Monoisotopic Mass:230.80860
Topological Polar Surface Area:23.8
Heavy Atom Count:6
Complexity:91
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,2-dibromo-2-chloro-acetonitrile

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

2,2-dibromo-2-chloro-acetonitrile

SDS

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