Home Amines 1015846-75-9
1015846-75-9,MFCD09971310
Catalog No.:AA0004TX
1015846-75-9 | Benzenamine, 4-(3-ethyl-1,2,4-oxadiazol-5-yl)-
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Technical Information
Catalog Number:
AA0004TX
Chemical Name:
Benzenamine, 4-(3-ethyl-1,2,4-oxadiazol-5-yl)-
CAS Number:
1015846-75-9
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
MDL Number:
MFCD09971310
IUPAC Name:
4-(3-ethyl-1,2,4-oxadiazol-5-yl)aniline
InChI:
InChI=1S/C10H11N3O/c1-2-9-12-10(14-13-9)7-3-5-8(11)6-4-7/h3-6H,2,11H2,1H3
InChI Key:
MEIZBKCDJIAJCZ-UHFFFAOYSA-N
SMILES:
CCc1noc(n1)c1ccc(cc1)N
Properties
Computed Properties
 
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.218g/mol
Monoisotopic Mass:
189.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Synonyms
 
4-(3-ETHYL-1,2,4-OXADIAZOL-5-YL)ANILINE 
1015846-75-9 
Y-6214 
Benzenamine, 4-(3-ethyl-1,2,4-oxadiazol-5-yl)- 
CTK3J9986 
DTXSID60651017 
MFCD09971310 
STL373802 
ZINC19093122 
AKOS009229440 
MCULE-5675710802 
AJ-72031 
Literature
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