Basic information
- Standard SMILES
COc1nn(-c2ccccc2OC)c(=O)o1- InChIKey
LTMQQEMGRMBUSL-UHFFFAOYSA-N- Molecular formula
- C10H10N2O4
- Average molar mass
- 222.2 g/mol
- Monoisotopic mass
- 222.0640568
Names & identifiers
- Preferred name
- 3-(2-Methoxyphenyl)-5-methoxy-1,3,4-oxadiazol-2(3H)-one
- IUPAC
- 5-methoxy-3-(2-methoxyphenyl)-1,3,4-oxadiazol-2-one
- English name
- METOXADIAZONE
- Molecular formula
- C10H10N2O4
- Molecular weight
- 222.2
Names & synonyms
3-(2-Methoxyphenyl)-5-methoxy-1,3,4-oxadiazol-2(3H)-oneRefChem:158395Metoxadiazone60589-06-2Metoxadiazone [ISO]1,3,4-Oxadiazol-2(3H)-one, 5-methoxy-3-(2-methoxyphenyl)-5-Methoxy-3-(2-methoxyphenyl)-1,3,4-oxadiazol-2(3H)-oneS-2107415Z0OMV86O32861 R.P.Methoxy-2(methoxy-2 phenyl)-4 oxadiazoline-1,3,4 one-5ELEMIC
Show more names
32861ValsanArs RedS 21074RP 3286132861R.P.5-methoxy-3-(2-methoxyphenyl)-1,3,4-oxadiazole-2 (3H)-one
BRN 1079854BRN 4462072UNII-15Z0OMV86O5-Methoxy-3-[2-methoxyphenyl]-1,3,4-oxadiazol-2(3H)-one5-methoxy-3-(2-methoxyphenyl)-1,3,4-oxadiazol-2-oneRPJ-168RP-32861Methoxy-2(methoxy-2 phenyl)-4 oxadiazoline-1,3,4 one-5 [French]
Database identifiers
- CAS
106728-68-1、60589-06-2- PubChem CID
- 43365
- DTXSID
DTXSID50866815- ChEBI
CHEBI:81164- UNII
- 15Z0OMV86O
- Nikkaji
- J65.683F
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 305
Physicochemical properties
- Boiling point
- 363.37 °C · 363.37°C (rough estimate)
- Density
- 1.3404 · 1.3404 (rough estimate)
- refractive index
- 1.63 · 1.6300 (estimate)
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- -0.95 · -0.95±0.40(Predicted)
- color
- Pale Yellow to Light Brown
- Stability
- Light Sensitive
- CAS DataBase Reference
- 60589 · 60589-06-2
- FDA UNII
- 15 Z0OMV86O · 15Z0OMV86O
- Toxicity
- 50 orl-rat: · LD50 orl-rat: 175 mg/kg IYKEDH 19,735,88
Safety & regulation
Safety data
- Toxicity
- LD50 orl-rat: 175 mg/kg IYKEDH 19,735,88
Chemistry & industry
Applications
UsesMetoxadiazone is used as an insecticide used to control rice hoppers, cockroaches and ants.
Upstream & downstream products
Upstream raw materials
Suppliers11 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
天津阿尔塔科技有限公司022-65378550-8551 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
南通市苏北化工原料有限公司0513-85290972 18762756250 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
湖北得安特化工科技有限公司15927262683 · [email protected]
上海杰股生物科技有限公司021-51698675 · [email protected]
广东翁江化学试剂有限公司0751-2815983 13927872582 · [email protected]
南通众合化工新材料有限公司0513-85666561 15950816326 · [email protected]
Additional notes
DefinitionChEBI: Metoxadiazone is a member of methoxybenzenes.
Related reactions
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