3-ethyl 5-methyl 4-amino-1,2-thiazole-3,5-dicarboxylate

3-ethyl 5-methyl 4-amino-1,2-thiazole-3,5-dicarboxylate

CAS: 632291-73-7

Formula: C8H10N2O4S

SMILES: CCOC(=O)C1=NSC(C(=O)OC)=C1N

IUPAC: 3-ethyl 5-methyl 4-amino-1,2-thiazole-3,5-dicarboxylate

InChI: InChI=1S/C8H10N2O4S/c1-3-14-7(11)5-4(9)6(15-10-5)8(12)13-2/h3,9H2,1-2H3

Composition: C (41.73%), H (4.38%), N (12.17%), O (27.80%), S (13.92%)

Molar Mass: 230.24

Atom Count: 25

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	230.036127984
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	DMOZGZGAMUJWAX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.91
Topological Polar Surface Area	91.51
Polarizability	20.2
Ring Count	1
Rotatable Bond Count	5

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