The store will not work correctly when cookies are disabled.
JavaScript seems to be disabled in your browser.
For the best experience on our site, be sure to turn on Javascript in your browser.
This is a demo store. No orders will be fulfilled.
We use cookies to keep things working smoothly and to improve your experience.
Choose what’s okay for you below. See our Cookie Policy .
Accept Cookies
1-Benzyl-pyrrolidine-3-carboxylic acid hydrazide - Reagent Grade, high purity , CAS No.474317-63-0
Basic Description
Synonyms
MFCD04038483 | 1-Benzyl-pyrrolidine-3-carboxylic acid hydrazide | 1-Benzylpyrrolidine-3-carboxylic acid hydrazide | ZTA31763 | FT-0644713 | 1-benzylpyrrolidine-3-carbohydrazide | 1-BENZYL-PYRROLIDINE-3-CARBOXYLIC ACID HYDRAZINE | 3-Pyrrolidinecarboxylicac
Specifications & Purity
Reagent grade
Legal Information
Product of Adesis
Grade
Reagent Grade
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Pyrrolidine carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolidinecarboxamides
Alternative Parents
Phenylmethylamines Benzylamines Aralkylamines N-alkylpyrrolidines Trialkylamines Carboxylic acid hydrazides Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzylamine - Phenylmethylamine - Pyrrolidine-3-carboxamide - Aralkylamine - Benzenoid - N-alkylpyrrolidine - Monocyclic benzene moiety - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid hydrazide - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolidinecarboxamides. These are pyrrolidines in which the pyrrolidine rings is substituted at one or more positions by a carboxamide group. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
IUPAC Name
1-benzylpyrrolidine-3-carbohydrazide
INCHI
InChI=1S/C12H17N3O/c13-14-12(16)11-6-7-15(9-11)8-10-4-2-1-3-5-10/h1-5,11H,6-9,13H2,(H,14,16)
InChIKey
UWQSMZMXPUMBSX-UHFFFAOYSA-N
Smiles
C1CN(CC1C(=O)NN)CC2=CC=CC=C2
Isomeric SMILES
C1CN(CC1C(=O)NN)CC2=CC=CC=C2
Molecular Weight
219.29
Reaxy-Rn
32094023
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=32094023&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Melt Point(°C)
83°
Molecular Weight
219.280 g/mol
XLogP3
0.400
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
3
Exact Mass
219.137 Da
Monoisotopic Mass
219.137 Da
Topological Polar Surface Area
58.400 Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
238.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
Solution Calculators
Molarity Calculator
Determine the necessary mass, volume, or concentration for preparing a solution.
Dilution Calculator
Determine the dilution needed to prepare a stock solution.
Reconstitution Calculator
Shall we send you a message when we have discounts available?
Remind me later
Allow
Thank you! Please check your email inbox to confirm.
Oops! Notifications are disabled.
