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methyl 4-propyl-1,2,3-thiadiazole-5-carboxylate

methyl 4-propyl-1,2,3-thiadiazole-5-carboxylate

Formula: C7H10N2O2S

SMILES: CCCC1=C(SN=N1)C(=O)OC

IUPAC: methyl 4-propyl-1,2,3-thiadiazole-5-carboxylate

InChI: InChI=1S/C7H10N2O2S/c1-3-4-5-6(7(10)11-2)12-9-8-5/h3-4H2,1-2H3

Composition: C (45.15%), H (5.41%), N (15.04%), O (17.18%), S (17.22%)

Molar Mass: 186.23

Atom Count: 22

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 186.046298744
Formal Charge 0
FSP3 0.57
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey PLVXVHMXGCJBTL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.98
Topological Polar Surface Area 52.08
Polarizability 17.26
Ring Count 1
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C7H10N2O2S $590.00-$2,860.00$590.00$1,540.00$2,860.00
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