5-[(2,6-Dichlorophenyl)(methoxy)methyl]-1,2,4-oxadiazol-3-amine
Basic information
- CAS
77831-57-3- Standard SMILES
COC(c1nc(N)no1)c1c(Cl)cccc1Cl- InChIKey
AVDYWJRUXBGVMB-UHFFFAOYSA-N- Molecular formula
- C10H9Cl2N3O2
- Average molar mass
- 274.1 g/mol
- Monoisotopic mass
- 273.0071819
Names & identifiers
- Preferred name
- 5-[(2,6-Dichlorophenyl)(methoxy)methyl]-1,2,4-oxadiazol-3-amine
- IUPAC
- 5-[(2,6-dichlorophenyl)-methoxymethyl]-1,2,4-oxadiazol-3-amine
Names & synonyms
77831-57-3NSC351206DTXSID503198365-[(2,6-Dichlorophenyl)(methoxy)methyl]-1,2,4-oxadiazol-3-amineNSC-351206
Database identifiers
- CAS
77831-57-3- PubChem CID
- 336532
- DTXSID
DTXSID50319836
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 250
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Compound notes
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