Cas no 1160574-24-2 (3,5-Dibromo-2-chlorobenzonitrile)

3,5-Dibromo-2-chlorobenzonitrile is a halogenated benzonitrile derivative with significant utility in organic synthesis and pharmaceutical intermediates. Its distinct substitution pattern—bromine at the 3 and 5 positions and chlorine at the 2 position—enhances its reactivity in cross-coupling reactions, such as Suzuki or Buchwald-Hartwig couplings, making it valuable for constructing complex aromatic frameworks. The electron-withdrawing nitrile group further facilitates nucleophilic substitution reactions. This compound is particularly useful in agrochemical and pharmaceutical research, where precise halogenation is critical for bioactivity. Its high purity and stability under standard conditions ensure consistent performance in synthetic applications.

3,5-Dibromo-2-chlorobenzonitrile structure

1160574-24-2 structure

Product Name:3,5-Dibromo-2-chlorobenzonitrile

CAS No:1160574-24-2

MF:C₇H₂Br₂ClN

MW:295.35847902298

CID:4561306

PubChem ID:50997958

Update Time:2025-06-09

3,5-Dibromo-2-chlorobenzonitrile Chemical and Physical Properties

Names and Identifiers

- 3,5-dibromo-2-chlorobenzonitrile
- 2-Chloro-3,5-dibromobenzonitrile
- D75962
- 1160574-24-2
- MFCD11846065
- AKOS037651318
- DB-203966
- C7H2Br2ClN
- CS-0098655
- CS-16484
- 3,5-Dibromo-2-chlorobenzonitrile
- MDL： MFCD11846065
- Inchi： 1S/C7H2Br2ClN/c8-5-1-4(3-11)7(10)6(9)2-5/h1-2H
- InChI Key： RFWLJSOZZJPDSE-UHFFFAOYSA-N
- SMILES： BrC1=CC(=CC(C#N)=C1Cl)Br

Computed Properties

Exact Mass: 294.82220g/mol
Monoisotopic Mass: 292.82425g/mol
Isotope Atom Count: 0
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 1
Heavy Atom Count: 11
Rotatable Bond Count: 0
Complexity: 188
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count : 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 3.7
Topological Polar Surface Area: 23.8

3,5-Dibromo-2-chlorobenzonitrile Pricemore >>

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SHANG HAI XIAN DING Biotechnology Co., Ltd.	B-LL889-250mg	3,5-Dibromo-2-chlorobenzonitrile	1160574-24-2	98%	250mg	935CNY	2021-05-07
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