3-(5-Ethyl-1,2,4-oxadiazol-3-yl)aniline - CAS 10364-74-6
Catalog: |
BB063320 |
Product Name: |
3-(5-Ethyl-1,2,4-oxadiazol-3-yl)aniline |
CAS: |
10364-74-6 |
Synonyms: |
3-(m-Aminophenyl)-5-ethyl-1,2,4-oxadiazole |
IUPAC Name: | 3-(5-ethyl-1,2,4-oxadiazol-3-yl)aniline |
Description: | 3-(5-Ethyl-1,2,4-oxadiazol-3-yl)aniline |
Molecular Weight: | 189.21 |
Molecular Formula: | C10H11N3O |
Canonical SMILES: | CCC1=NC(=NO1)C2=CC(=CC=C2)N |
InChI: | InChI=1S/C10H11N3O/c1-2-9-12-10(13-14-9)7-4-3-5-8(11)6-7/h3-6H,2,11H2,1H3 |
InChI Key: | CCCJFRBTBUSWBP-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 188 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.090211983 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.090211983 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 64.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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