ethyl 2-(1,3-thiazol-2-yl)acetate

ethyl 2-(1,3-thiazol-2-yl)acetate

CAS: 141704-11-2

Formula: C7H9NO2S

SMILES: CCOC(=O)CC1=NC=CS1

IUPAC: ethyl 2-(1,3-thiazol-2-yl)acetate

InChI: InChI=1S/C7H9NO2S/c1-2-10-7(9)5-6-8-3-4-11-6/h3-4H,2,5H2,1H3

Composition: C (49.11%), H (5.30%), N (8.18%), O (18.69%), S (18.73%)

Molar Mass: 171.21

Atom Count: 20

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	171.035399708
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	OTMKLBXQEYBHJE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	41.57
Topological Polar Surface Area	39.19
Polarizability	16.3
Ring Count	1
Rotatable Bond Count	4

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