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1-Methyl-1H-1,2,3-triazole-5-carboxylic acid - 97%, high purity , CAS No.716361-91-0

COA

Grade & Purity:

≥97%

Cas Number: 716361-91-0
Molecular Weight: 127.1
PubChem CID: 20577143

In stock

Item Number

M194739

Grouped product items
SKU	Size	Availability	Price	Qty
M194739-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$50.90
M194739-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$211.90

Discover 1-Methyl-1H-1,2,3-triazole-5-carboxylic acid by Aladdin Scientific in 97% for only $50.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	1-Methyl-1H-1,2,3-triazole-5-carboxylic acid \| 716361-91-0 \| 3-methyltriazole-4-carboxylic acid \| MFCD10696347 \| SCHEMBL263100 \| DTXSID00608909 \| LQNKEDJEXCZEBP-UHFFFAOYSA-N \| AKOS006283437 \| AB57108 \| CS-W003953 \| DS-11990 \| SY108425 \| FT-0741615 \| 1-Methyl-1H-1,2,3-triazole-5-ca
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azoles
    - Subclass Triazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azoles
Subclass	Triazoles
Intermediate Tree Nodes	Not available
Direct Parent	Triazoles
Alternative Parents	Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Heteroaromatic compound - 1,2,3-triazole - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as triazoles. These are compounds containing a five-member aromatic ring of two carbon atoms and three nitrogen atoms.
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

IUPAC Name	3-methyltriazole-4-carboxylic acid
INCHI	InChI=1S/C4H5N3O2/c1-7-3(4(8)9)2-5-6-7/h2H,1H3,(H,8,9)
InChIKey	LQNKEDJEXCZEBP-UHFFFAOYSA-N
Smiles	CN1C(=CN=N1)C(=O)O
Isomeric SMILES	CN1C(=CN=N1)C(=O)O
Molecular Weight	127.1
Reaxy-Rn	126774
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=126774&ln=

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

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	127.100 g/mol
XLogP3	-0.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	127.038 Da
Monoisotopic Mass	127.038 Da
Topological Polar Surface Area	68.000 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	127.000
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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