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6-(2-(tert-Butoxycarbonyl)hydrazinyl)nicotinic acid - 95%, high purity , CAS No.133081-25-1

COA

Grade & Purity:

≥95%

Cas Number: 133081-25-1
Molecular Weight: 253.25
PubChem CID: 11311327
PubChem SID: 504766281

In stock

Item Number

T190584

Grouped product items
SKU	Size	Availability	Price
T190584-50mg	50mg	3	$14.90
T190584-250mg	250mg	3	$58.90
T190584-1g	1g	2	$145.90
T190584-5g	5g	1	$507.90
T190584-10g	10g	1	$852.90

Basic Description

Synonyms	133081-25-1 \| 6-(2-(tert-butoxycarbonyl)hydrazinyl)nicotinic acid \| 6-Boc-hydrazinonicotinic acid \| 6-[2-(tert-Butoxycarbonyl)hydrazinyl]nicotinic acid \| 6-Boc-Hydrazynonicotinic acid \| 6-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]pyridine-3-carboxylic Acid \| MF
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Pyridinecarboxylic acids and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Pyridinecarboxylic acids
Alternative Parents	Imidolactams Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Pyridine carboxylic acid - Imidolactam - Heteroaromatic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group.
External Descriptors	Not available
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. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504766281
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504766281
IUPAC Name	6-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]pyridine-3-carboxylic acid
INCHI	InChI=1S/C11H15N3O4/c1-11(2,3)18-10(17)14-13-8-5-4-7(6-12-8)9(15)16/h4-6H,1-3H3,(H,12,13)(H,14,17)(H,15,16)
InChIKey	DBNGJNCAXKNLLQ-UHFFFAOYSA-N
Smiles	CC(C)(C)OC(=O)NNC1=NC=C(C=C1)C(=O)O
Isomeric SMILES	CC(C)(C)OC(=O)NNC1=NC=C(C=C1)C(=O)O
PubChem CID	11311327
Molecular Weight	253.25

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

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Lot Number	Certificate Type	Date	Item
E1907001	Certificate of Analysis	Oct 22, 2024	T190584

Chemical and Physical Properties

Molecular Weight	253.250 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Exact Mass	253.106 Da
Monoisotopic Mass	253.106 Da
Topological Polar Surface Area	101.000 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	314.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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