Home Amines 1177273-70-9
1177273-70-9,MFCD16653004
Catalog No.:AA01AQLE
1177273-70-9 | 5-(2,5-Dichloro-3-thienyl)-1,3,4-oxadiazol-2-amine
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Technical Information
Catalog Number:
AA01AQLE
Chemical Name:
5-(2,5-Dichloro-3-thienyl)-1,3,4-oxadiazol-2-amine
CAS Number:
1177273-70-9
Molecular Formula:
C6H3Cl2N3OS
Molecular Weight:
236.0785
MDL Number:
MFCD16653004
IUPAC Name:
5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-amine
InChI:
InChI=1S/C6H3Cl2N3OS/c7-3-1-2(4(8)13-3)5-10-11-6(9)12-5/h1H,(H2,9,11)
InChI Key:
KHVAKNVBHVGVCR-UHFFFAOYSA-N
SMILES:
Nc1nnc(o1)c1cc(sc1Cl)Cl
Properties
Computed Properties
 
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.937g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.07g/mol
Monoisotopic Mass:
234.937g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Synonyms
 
5-(2,5-dichloro-3-thienyl)-1,3,4-oxadiazol-2-amine 
1177273-70-9 
5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-amine 
ZINC34936066 
AKOS015957754 
MCULE-9136361856 
L-3010 
F2146-0612 
Literature
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