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ethyl 5-(2-methylphenyl)-1,3-thiazole-2-carboxylate

ethyl 5-(2-methylphenyl)-1,3-thiazole-2-carboxylate

Formula: C13H13NO2S

SMILES: CCOC(=O)C1=NC=C(S1)C1=C(C)C=CC=C1

IUPAC: ethyl 5-(2-methylphenyl)-1,3-thiazole-2-carboxylate

InChI: InChI=1S/C13H13NO2S/c1-3-16-13(15)12-14-8-11(17-12)10-7-5-4-6-9(10)2/h4-8H,3H2,1-2H3

Composition: C (63.14%), H (5.30%), N (5.66%), O (12.94%), S (12.96%)

Molar Mass: 247.31

Atom Count: 30

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 247.066699837
Formal Charge 0
FSP3 0.23
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey FJFQTGBQFPKCQA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.48
Topological Polar Surface Area 39.19
Polarizability 27.11
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C13H13NO2S $1,320.00-$2,640.00$1,320.00$1,640.00$2,640.00
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