chempirical

Ethyl 2-amino-4-thiazoleacetate

C7H10N2O2SCAS 53266-94-7186.23 g/mol

Open in Covalent MOL file
OOSNHHN
Ester

Properties

Molecular formula
C7H10N2O2S
Molar mass
186.23 g/mol
Exact mass
186.0463 Da
Melting point
94–95 °C
logP
0.66Crippen estimate
Polar surface area
65.9 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
3

Identifiers

CAS number
53266-94-7
SMILES
CCOC(=O)Cc1csc(=N)[nH]1
InChIKey
SHQNGLYXRFCPGZ-UHFFFAOYSA-N
InChI
InChI=1S/C7H10N2O2S/c1-2-11-6(10)3-5-4-12-7(8)9-5/h4H,2-3H2,1H3,(H2,8,9)

Weigh it out

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

Names and synonyms

13 names · show all
  • 4-Thiazoleacetic acid, 2-amino-, ethyl ester
  • (2-Amino-thiazole-4-yl)acetic acid ethyl ester
  • Ethyl 2-(2-amino-1,3-thiazol-4-yl)acetate
  • Ethyl (2-amino-1,3-thiazol-4-yl)acetate
  • Ethyl 2-aminothiazol-4-ylacetate
  • 2-Amino-4-(carbethoxymethyl)thiazole
  • 2-Amino-4-thiazoleacetic acid ethyl ester
  • (2-Amino-1,3-thiazol-4-yl)acetic acid ethyl ester
  • Ethyl 2-(2-aminothiazol-4-yl)acetate
  • (2-Amino-4-thiazolyl)acetic acid ethyl ester
  • 2-(2-Aminothiazol-4-yl)acetic acid ethyl ester
  • 2-Amino-4-[(ethoxycarbonyl)methyl]thiazole
  • 2-Amino-4-(ethoxycarbonylmethyl)-1,3-thiazole

Work with Ethyl 2-amino-4-thiazoleacetate

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-amino-4-thiazolecarboxylate5398-36-759 % similar 4-Thiazolecarboxylic acid, 2-amino-, ethyl ester, hydrochloride (1:1)435342-17-955 % similar 2-Amino-4-thiazoleacetic acid29676-71-954 % similar Ethyl 2-thienylacetate57382-97-550 % similar Ethyl (αz)-2-amino-α-(hydroxyimino)-4-thiazoleacetate64485-82-149 % similar Ethyl (αz)-2-amino-α-(methoxyimino)-4-thiazoleacetate64485-88-748 % similar Ethyl phenylacetate101-97-345 % similar Ethyl p-tolylacetate14062-19-243 % similar

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

Same formula

2-[1-(Ethylsulfonyl)-3-azetidinylidene]acetonitrile1187595-85-2 Tosylhydrazine1576-35-8 Carbimazole22232-54-8 4,6-Dimethyl-2-(methylsulfonyl)pyrimidine35144-22-0 4-Amino-3-methylbenzenesulfonamide53297-70-4 3-Amino-4-methylbenzenesulfonamide6274-28-8 5-Amino-2-methylbenzenesulfonamide6973-09-7 P-(Methylsulfonyl)phenylhydrazine877-66-7

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