2-Amino-3-(methoxycarbonyl)pyrazine

C₆H₇N₃O₂CAS 16298-03-6153.14 g/mol

Open in Covalent MOL file

Ester Primary amine

Properties

Molecular formula: C₆H₇N₃O₂
Molar mass: 153.14 g/mol
Exact mass: 153.0538 Da
Melting point: 172 °C
logP: -0.15Crippen estimate
Polar surface area: 78.1 Å²
H-bond donors / acceptors: 1 / 5
Rotatable bonds: 1

Hazards

Warning

H315 Causes skin irritation58.3% of notifiers
H319 Causes serious eye irritation58.3% of notifiers
H335 May cause respiratory irritation50% of notifiers
H412 Harmful to aquatic life with long lasting effects50% of notifiers

Aggregated from 12 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

16298-03-6

SMILES

COC(=O)c1nccnc1N

InChIKey

INCSQLZZXBPATR-UHFFFAOYSA-N

InChI

InChI=1S/C6H7N3O2/c1-11-6(10)4-5(7)9-3-2-8-4/h2-3H,1H3,(H2,7,9)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names

2-Pyrazinecarboxylic acid, 3-amino-, methyl ester
Pyrazinecarboxylic acid, 3-amino-, methyl ester
Pyrazinoic acid, 3-amino-, methyl ester
Methyl 3-aminopyrazinecarboxylate
Methyl 3-aminopyrazine-2-carboxylate
3-Aminopyrazine-2-carboxylic acid methyl ester
Methyl 2-aminopyrazine-3-carboxylate
NSC 123649

Work with 2-Amino-3-(methoxycarbonyl)pyrazine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Methyl 3-chloropyrazine-2-carboxylate27825-21-459 % similar Methyl 3-bromopyrazine-2-carboxylate51171-02-959 % similar Methyl 2-aminopyridine-3-carboxylate14667-47-158 % similar Methyl 3-amino-2-pyridinecarboxylate36052-27-458 % similar Methyl 3-amino-6-chloropyrazine-2-carboxylate1458-03-358 % similar Methyl 3-amino-6-bromopyrazine-2-carboxylate6966-01-458 % similar Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate1458-18-053 % similar 2,3-Dimethyl 2,3-pyridinedicarboxylate605-38-953 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(4-Nitrophenyl)hydrazine100-16-3 1-Hydroxy-1H-benzotriazole hydrate (1:?)123333-53-9 6-Hydrazinonicotinic acid133081-24-0 5-Aminopyrazine-2-carboxylic acid methyl ester13924-94-2 N4-Acetylcytosine14631-20-0 2-Amino-3-methyl-5-nitropyridine18344-51-9 2-Amino-3-nitro-6-picoline21901-29-1 2-Amino-5-nitro-4-picoline21901-40-6

Elsewhere

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