Ethyl 2-amino-1,3-oxazole-4-carboxylate

C₆H₈N₂O₃CAS 177760-52-0156.14 g/mol

Open in Covalent MOL file

Ester Primary amine

Properties

Molecular formula: C₆H₈N₂O₃
Molar mass: 156.14 g/mol
Exact mass: 156.0535 Da
logP: 0.43Crippen estimate
Polar surface area: 78.3 Å²
H-bond donors / acceptors: 1 / 5
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed33.3% of notifiers
H312 Harmful in contact with skin33.3% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled33.3% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

177760-52-0

SMILES

CCOC(=O)C1=COC(=N1)N

InChIKey

NBABLVASYFPOEV-UHFFFAOYSA-N

InChI

InChI=1S/C6H8N2O3/c1-2-10-5(9)4-3-11-6(7)8-4/h3H,2H2,1H3,(H2,7,8)

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

Names and synonyms

1 names

Ethyl 2-aminooxazole-4-carboxylate

Work with Ethyl 2-amino-1,3-oxazole-4-carboxylate

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

Ethyl 2-chlorooxazole-4-carboxylate460081-18-964 % similar Ethyl 2-bromo-1,3-oxazole-4-carboxylate460081-20-364 % similar Ethyl 2-(4'-hydroxyphenyl)-1,3-oxazole-4-carboxylate200400-76-654 % similar Diethyl 2,6-pyridinedicarboxylate15658-60-353 % similar Ethyl oxazole-4-carboxylate23012-14-853 % similar 5-Amino-1,3,4-oxadiazole-2-carboxylic acid ethyl ester4970-53-053 % similar 6-Aminopyridine-2-carboxylic acid ethyl ester69142-64-952 % similar 5-Aminopyrazine-2-carboxylic acid ethyl ester54013-06-850 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Ethyl 2-amino-1,3-oxazole-5-carboxylate113853-16-0 5-Hydroxy-1-methyl-1H-pyrazole-3-carboxylic acid methyl ester51985-95-6 Ethyl N-(2-cyanoacetyl)carbamate6629-04-5 Dimethylbarbituric acid769-42-6

Elsewhere

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