Basic information
- CAS
37384-61-5- Standard SMILES
COC(=O)c1noc(-c2ccccc2)n1- InChIKey
GBLKMWNAOLRGES-UHFFFAOYSA-N- Molecular formula
- C10H8N2O3
- Average molar mass
- 204.18 g/mol
- Monoisotopic mass
- 204.05349212
Names & identifiers
- Preferred name
- Methyl 5-phenyl-1,2,4-oxadiazole-3-carboxylate
- IUPAC
- methyl 5-phenyl-1,2,4-oxadiazole-3-carboxylate
- English name
- METHYL 5-PHENYL-1,2,4-OXADIAZOLE-3-CARBOXYLATE
- Molecular formula
- C10H8N2O3
- Molecular weight
- 204.18
Names & synonyms
methyl 5-phenyl-1,2,4-oxadiazole-3-carboxylate37384-61-5DTXSID00351867RefChem:356177DTXCID80302933MFCD00974530HMS1551O02TimTec1_006294GBLKMWNAOLRGES-UHFFFAOYSA-NSMSSF-0056939SBB093277STK076965
Show more names
1,2,4-Oxadiazole-3-carboxylic acid, 5-phenyl-, methyl ester
AKOS0006014714L-330SST065077DB-049100CS-0314064F3349-0005[1,2,4]Oxadiazole-3-carboxylic acid, 5-phenyl-, methyl ester
Database identifiers
- CAS
37384-61-5- PubChem CID
- 712092
- DTXSID
DTXSID00351867
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- Melting point
- 113 · 113-116°C
- Boiling point
- 330.6 · 330.6±25.0 °C(Predicted)
- Density
- 1.261 · 1.261±0.06 g/cm3(Predicted)
- pka
- -4.07 · -4.07±0.20(Predicted)
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers8 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海合寰化工科技有限公司18621911604 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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