Home Carboxys ethyl 5-ethyl-1,3,4-thiadiazole-2-carboxylate

ethyl 5-ethyl-1,3,4-thiadiazole-2-carboxylate

CAS No.:
1330751-86-4
Catalog Number:
AG01BUQ7
Molecular Formula:
C7H10N2O2S
Molecular Weight:
186.2315
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Product Description
Catalog Number:
AG01BUQ7
Chemical Name:
ethyl 5-ethyl-1,3,4-thiadiazole-2-carboxylate
CAS Number:
1330751-86-4
Molecular Formula:
C7H10N2O2S
Molecular Weight:
186.2315
MDL Number:
MFCD19981642
IUPAC Name:
ethyl 5-ethyl-1,3,4-thiadiazole-2-carboxylate
InChI:
InChI=1S/C7H10N2O2S/c1-3-5-8-9-6(12-5)7(10)11-4-2/h3-4H2,1-2H3
InChI Key:
KTDGOBVYXGZBAQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nnc(s1)CC
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.046g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.229g/mol
Monoisotopic Mass:
186.046g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties