1-Benzylpyrrolidine-3-carbonitrile oxalate
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Product
1-Benzylpyrrolidine-3-carbonitrile oxalate
CAS
1188265-21-5
Formula
C14H16N2O4
Product Description
1-Benzylpyrrolidine-3-carbonitrile oxalate is a chemical compound with the formula C14H16N2O4. It is recognized for its potential applications in pharmaceutical research and development, particularly as an intermediate in the synthesis of various active pharmaceutical ingredients.
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Typical Product Specifications
Chemical Structure
Canonicalized Compound
1
Compound Complexity
293
Hydrogen Bond Acceptor Count
6
Hydrogen Bond Donor Count
2
Rotatable Bond Count
3
Allowed IUPAC Name
1-benzylpyrrolidine-3-carbonitrile;oxalic acid
CAS-like Style IUPAC Name
oxalic acid;1-(phenylmethyl)-3-pyrrolidinecarbonitrile
Markup IUPAC Name
1-benzylpyrrolidine-3-carbonitrile;oxalic acid
Preferred IUPAC Name
1-benzylpyrrolidine-3-carbonitrile;oxalic acid
Systematic IUPAC Name
ethanedioic acid;1-(phenylmethyl)pyrrolidine-3-carbonitrile
Traditional IUPAC Name
1-benzylpyrrolidine-3-carbonitrile;oxalic acid
Standard InChI
InChI=1S/C12H14N2.C2H2O4/c13-8-12-6-7-14(10-12)9-11-4-2-1-3-5-11;3-1(4)2(5)6/h1-5,12H,6-7,9-10H2;(H,3,4)(H,5,6)
Standard InChIKey
NLBJMBNDZZMLDI-UHFFFAOYSA-N
Exact Mass
276.11100700
Molecular Weight
276.29
Canonical SMILES
C1CN(CC1C#N)CC2=CC=CC=C2.C(=O)(C(=O)O)O
Isomeric SMILES
C1CN(CC1C#N)CC2=CC=CC=C2.C(=O)(C(=O)O)O
Polar Surface Area Topological
102
MonoIsotopic Weight
276.11100700
Class
Uses of 1-Benzylpyrrolidine-3-carbonitrile oxalate
This compound is primarily used in the pharmaceutical industry as an intermediate in the synthesis of drugs, its unique chemical structure allows it to be utilized in the development of new therapeutic agents, particularly in the fields of neuroscience and pain management.
Industries that use 1-Benzylpyrrolidine-3-carbonitrile oxalate
- Pharmaceutical - In the pharmaceutical industry, 1-Benzylpyrrolidine-3-carbonitrile oxalate is used as a building block for the synthesis of various drugs, contributing to the development of new medications.
- Chemical Manufacturing - Chemical manufacturers utilize this compound in the production of other chemical intermediates, enhancing the efficiency of their synthesis processes.
- Research and Development - In R&D settings, this compound is studied for its potential therapeutic effects and applications, driving innovation in drug discovery.
Related Products
- Complementary Products
- Alternative Products
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1-Benzylpyrrolidine-3-carbonitrile oxalate
Product
1-Benzylpyrrolidine-3-carbonitrile oxalate
CAS
1188265-21-5
Formula
C14H16N2O4
Product Description
1-Benzylpyrrolidine-3-carbonitrile oxalate is a chemical compound with the formula C14H16N2O4. It is recognized for its potential applications in pharmaceutical research and development, particularly as an intermediate in the synthesis of various active pharmaceutical ingredients.
Need a quote for 1-Benzylpyrrolidine-3-carbonitrile oxalate?
Please fill out the RFQ form, and one of our representatives will contact you as soon as possible.
Typical Product Specifications
Chemical Structure
Canonicalized Compound
1
Compound Complexity
293
Hydrogen Bond Acceptor Count
6
Hydrogen Bond Donor Count
2
Rotatable Bond Count
3
Allowed IUPAC Name
1-benzylpyrrolidine-3-carbonitrile;oxalic acid
CAS-like Style IUPAC Name
oxalic acid;1-(phenylmethyl)-3-pyrrolidinecarbonitrile
Markup IUPAC Name
1-benzylpyrrolidine-3-carbonitrile;oxalic acid
Preferred IUPAC Name
1-benzylpyrrolidine-3-carbonitrile;oxalic acid
Systematic IUPAC Name
ethanedioic acid;1-(phenylmethyl)pyrrolidine-3-carbonitrile
Traditional IUPAC Name
1-benzylpyrrolidine-3-carbonitrile;oxalic acid
Standard InChI
InChI=1S/C12H14N2.C2H2O4/c13-8-12-6-7-14(10-12)9-11-4-2-1-3-5-11;3-1(4)2(5)6/h1-5,12H,6-7,9-10H2;(H,3,4)(H,5,6)
Standard InChIKey
NLBJMBNDZZMLDI-UHFFFAOYSA-N
Exact Mass
276.11100700
Molecular Weight
276.29
Canonical SMILES
C1CN(CC1C#N)CC2=CC=CC=C2.C(=O)(C(=O)O)O
Isomeric SMILES
C1CN(CC1C#N)CC2=CC=CC=C2.C(=O)(C(=O)O)O
Polar Surface Area Topological
102
MonoIsotopic Weight
276.11100700
Class
Uses of 1-Benzylpyrrolidine-3-carbonitrile oxalate
This compound is primarily used in the pharmaceutical industry as an intermediate in the synthesis of drugs, its unique chemical structure allows it to be utilized in the development of new therapeutic agents, particularly in the fields of neuroscience and pain management.
Industries that use 1-Benzylpyrrolidine-3-carbonitrile oxalate
- Pharmaceutical - In the pharmaceutical industry, 1-Benzylpyrrolidine-3-carbonitrile oxalate is used as a building block for the synthesis of various drugs, contributing to the development of new medications.
- Chemical Manufacturing - Chemical manufacturers utilize this compound in the production of other chemical intermediates, enhancing the efficiency of their synthesis processes.
- Research and Development - In R&D settings, this compound is studied for its potential therapeutic effects and applications, driving innovation in drug discovery.
Related Products
- Complementary Products
- Alternative Products
Contact Us
