Benzonitrile, 2-chloro-5-nitro-
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Product
Benzonitrile, 2-chloro-5-nitro-
CAS
16588-02-6
Formula
C7H3ClN2O2
Product Description
Benzonitrile, 2-chloro-5-nitro- (CAS: 16588-02-6) is a chemical compound with the formula C7H3ClN2O2. It is characterized by its nitro and chloro substituents on the benzene ring, making it a valuable intermediate in organic synthesis.
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Typical Product Specifications
Chemical Structure
Chemical Structure
Canonicalized Compound
1
Compound Complexity
229
Hydrogen Bond Acceptor Count
3
Allowed IUPAC Name
2-chloro-5-nitro-benzonitrile
CAS-like Style IUPAC Name
2-chloro-5-nitrobenzonitrile
Markup IUPAC Name
2-chloro-5-nitrobenzonitrile
Preferred IUPAC Name
2-chloro-5-nitrobenzonitrile
Systematic IUPAC Name
2-chloranyl-5-nitro-benzenecarbonitrile
Traditional IUPAC Name
2-chloro-5-nitro-benzonitrile
Standard InChI
InChI=1S/C7H3ClN2O2/c8-7-2-1-6(10(11)12)3-5(7)4-9/h1-3H
Standard InChIKey
ZGILLTVEEBNDOB-UHFFFAOYSA-N
Exact Mass
181.9883050
Molecular Weight
182.56
Canonical SMILES
C1=CC(=C(C=C1[N+](=O)[O-])C#N)Cl
Isomeric SMILES
C1=CC(=C(C=C1[N+](=O)[O-])C#N)Cl
Polar Surface Area Topological
69.6
MonoIsotopic Weight
181.9883050
XLogP3 Log P
2.2
Class
Uses of Benzonitrile, 2-chloro-5-nitro-
This compound is primarily used as a chemical intermediate in the synthesis of various pharmaceuticals and agrochemicals. Its unique structure allows it to participate in reactions that lead to the formation of more complex molecules, making it essential in the development of active pharmaceutical ingredients (APIs) and other specialty chemicals.
Industries that use Benzonitrile, 2-chloro-5-nitro-
- Pharmaceuticals - In the pharmaceutical industry, 2-chloro-5-nitrobenzonitrile is utilized in the synthesis of various drugs, contributing to the development of new therapeutic agents.
- Agriculture - In agriculture, this compound serves as an intermediate in the production of agrochemicals, including pesticides and herbicides, enhancing crop protection.
- Chemical Manufacturing - Chemical manufacturers use this compound as a building block for creating a range of specialty chemicals, facilitating the production of diverse chemical products.
Related Products
- Complementary Products
- Alternative Products
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Benzonitrile, 2-chloro-5-nitro-
Product
Benzonitrile, 2-chloro-5-nitro-
CAS
16588-02-6
Formula
C7H3ClN2O2
Product Description
Benzonitrile, 2-chloro-5-nitro- (CAS: 16588-02-6) is a chemical compound with the formula C7H3ClN2O2. It is characterized by its nitro and chloro substituents on the benzene ring, making it a valuable intermediate in organic synthesis.
Need a quote for Benzonitrile, 2-chloro-5-nitro-?
Please fill out the RFQ form, and one of our representatives will contact you as soon as possible.
Typical Product Specifications
Chemical Structure
Chemical Structure
Canonicalized Compound
1
Compound Complexity
229
Hydrogen Bond Acceptor Count
3
Allowed IUPAC Name
2-chloro-5-nitro-benzonitrile
CAS-like Style IUPAC Name
2-chloro-5-nitrobenzonitrile
Markup IUPAC Name
2-chloro-5-nitrobenzonitrile
Preferred IUPAC Name
2-chloro-5-nitrobenzonitrile
Systematic IUPAC Name
2-chloranyl-5-nitro-benzenecarbonitrile
Traditional IUPAC Name
2-chloro-5-nitro-benzonitrile
Standard InChI
InChI=1S/C7H3ClN2O2/c8-7-2-1-6(10(11)12)3-5(7)4-9/h1-3H
Standard InChIKey
ZGILLTVEEBNDOB-UHFFFAOYSA-N
Exact Mass
181.9883050
Molecular Weight
182.56
Canonical SMILES
C1=CC(=C(C=C1[N+](=O)[O-])C#N)Cl
Isomeric SMILES
C1=CC(=C(C=C1[N+](=O)[O-])C#N)Cl
Polar Surface Area Topological
69.6
MonoIsotopic Weight
181.9883050
XLogP3 Log P
2.2
Class
Uses of Benzonitrile, 2-chloro-5-nitro-
This compound is primarily used as a chemical intermediate in the synthesis of various pharmaceuticals and agrochemicals. Its unique structure allows it to participate in reactions that lead to the formation of more complex molecules, making it essential in the development of active pharmaceutical ingredients (APIs) and other specialty chemicals.
Industries that use Benzonitrile, 2-chloro-5-nitro-
- Pharmaceuticals - In the pharmaceutical industry, 2-chloro-5-nitrobenzonitrile is utilized in the synthesis of various drugs, contributing to the development of new therapeutic agents.
- Agriculture - In agriculture, this compound serves as an intermediate in the production of agrochemicals, including pesticides and herbicides, enhancing crop protection.
- Chemical Manufacturing - Chemical manufacturers use this compound as a building block for creating a range of specialty chemicals, facilitating the production of diverse chemical products.
Related Products
- Complementary Products
- Alternative Products
Contact Us
