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methyl 5-aminopyrimidine-2-carboxylate - 97%, high purity
Discover methyl 5-aminopyrimidine-2-carboxylate by Aladdin Scientific in 97% for only $217.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
Methyl 5-aminopyrimidine-2-carboxylate | 73418-88-9 | SCHEMBL9950882 | DTXSID70442978 | NYYBCNDGMLXGQQ-UHFFFAOYSA-N | 5-amino-2-methoxycarbonylpyrimidine | AMY11783 | YCA41888 | MFCD08234876 | AKOS005137933 | PB10524 | AS-41911 | CS-0049006 | FT-0756257 | EN300-4285588 | 5-amino-pyrim
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Pyrimidinecarboxylic acids and derivatives
Direct Parent
Pyrimidinecarboxylic acids
Alternative Parents
Aminopyrimidines and derivatives Methyl esters Heteroaromatic compounds Amino acids and derivatives Azacyclic compounds Primary amines Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidine-2-carboxylic acid - Aminopyrimidine - Heteroaromatic compound - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Primary amine - Organooxygen compound - Organonitrogen compound - Organic oxide - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids. These are pyrimidines with a structure containing a carboxyl group attached to the pyrimidine ring.
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
methyl 5-aminopyrimidine-2-carboxylate
INCHI
InChI=1S/C6H7N3O2/c1-11-6(10)5-8-2-4(7)3-9-5/h2-3H,7H2,1H3
InChIKey
NYYBCNDGMLXGQQ-UHFFFAOYSA-N
Smiles
COC(=O)C1=NC=C(C=N1)N
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
153.140 g/mol
XLogP3
-1.400
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
2
Exact Mass
153.054 Da
Monoisotopic Mass
153.054 Da
Topological Polar Surface Area
78.100 Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
143.000
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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