1,3,4-Oxadiazol-2-amine, 5-((2,5-dichlorophenoxy)methyl)-N-ethyl-
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Basic information
- CAS
40056-70-0- Standard SMILES
CCNc1nnc(COc2cc(Cl)ccc2Cl)o1- InChIKey
QESFBFZETJDDBC-UHFFFAOYSA-N- Molecular formula
- C11H11Cl2N3O2
- Average molar mass
- 288.13 g/mol
- Monoisotopic mass
- 287.022832
Names & identifiers
- Preferred name
- 1,3,4-Oxadiazol-2-amine, 5-((2,5-dichlorophenoxy)methyl)-N-ethyl-
- IUPAC
- 5-[(2,5-dichlorophenoxy)methyl]-N-ethyl-1,3,4-oxadiazol-2-amine
Names & synonyms
40056-70-0BRN 10119955-((2,5-Dichlorophenoxy)methyl)-N-ethyl-1,3,4-oxadiazol-2-amine5-[(2,5-dichlorophenoxy)methyl]-n-ethyl-1,3,4-oxadiazol-2-amine1,3,4-Oxadiazol-2-amine, 5-((2,5-dichlorophenoxy)methyl)-N-ethyl-DTXSID90193117RefChem:216860DTXCID00115608
Database identifiers
- CAS
40056-70-0- PubChem CID
- 218035
- DTXSID
DTXSID90193117
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 260
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Compound notes
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