Home Other Building Blocks 2-[3-(1,2,4-thiadiazol-5-yloxy)phenyl]acetic acid

2-[3-(1,2,4-thiadiazol-5-yloxy)phenyl]acetic acid

CAS No.:
1478992-30-1
Catalog Number:
AG01C3IK
Molecular Formula:
C10H8N2O3S
Molecular Weight:
236.2471
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Product Description
Catalog Number:
AG01C3IK
Chemical Name:
2-[3-(1,2,4-thiadiazol-5-yloxy)phenyl]acetic acid
CAS Number:
1478992-30-1
Molecular Formula:
C10H8N2O3S
Molecular Weight:
236.2471
MDL Number:
MFCD21211335
IUPAC Name:
2-[3-(1,2,4-thiadiazol-5-yloxy)phenyl]acetic acid
InChI:
InChI=1S/C10H8N2O3S/c13-9(14)5-7-2-1-3-8(4-7)15-10-11-6-12-16-10/h1-4,6H,5H2,(H,13,14)
InChI Key:
ZSQJFRUYNUCBLO-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cccc(c1)Oc1ncns1
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.026g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.245g/mol
Monoisotopic Mass:
236.026g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties