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

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

CAS No.:
1330755-46-8
Catalog Number:
AG01BVAJ
Molecular Formula:
C8H10N2O2S
Molecular Weight:
198.2422
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Product Description
Catalog Number:
AG01BVAJ
Chemical Name:
ethyl 5-cyclopropyl-1,3,4-thiadiazole-2-carboxylate
CAS Number:
1330755-46-8
Molecular Formula:
C8H10N2O2S
Molecular Weight:
198.2422
MDL Number:
MFCD19981635
IUPAC Name:
ethyl 5-cyclopropyl-1,3,4-thiadiazole-2-carboxylate
InChI:
InChI=1S/C8H10N2O2S/c1-2-12-8(11)7-10-9-6(13-7)5-3-4-5/h5H,2-4H2,1H3
InChI Key:
UEARHRMLGMIDMJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nnc(s1)C1CC1
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.046g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.24g/mol
Monoisotopic Mass:
198.046g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties