Basic information
- CAS
54608-93-4- Standard SMILES
O=[N+]([O-])c1ccc(-c2noc(C3CCCCC3)n2)cc1- InChIKey
QCKSSCILOJWUDG-UHFFFAOYSA-N- Molecular formula
- C14H15N3O3
- Average molar mass
- 273.29 g/mol
- Monoisotopic mass
- 273.11134135
Names & identifiers
- Preferred name
- 5-Cyclohexyl-3-(4-nitrophenyl)-1,2,4-oxadiazole
- IUPAC
- 5-cyclohexyl-3-(4-nitrophenyl)-1,2,4-oxadiazole
- English name
- 5-Cyclohexyl-3-(4-nitrophenyl)-1,2,4-oxadiazole
- Molecular formula
- C14H15N3O3
- Molecular weight
- 273.29
Names & synonyms
5-cyclohexyl-3-(4-nitrophenyl)-1,2,4-oxadiazole54608-93-4MFCD01933303Cambridge id 6149462Oprea1_058645DTXSID90367492STK140362AKOS002082545BS-23391CS-0210309SR-01000552260SR-01000552260-1
Show more names
1,2,4-Oxadiazole, 5-cyclohexyl-3-(4-nitrophenyl)-
Database identifiers
- CAS
54608-93-4- PubChem CID
- 2270232
- DTXSID
DTXSID90367492
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 333
Physicochemical properties
- storage temp.
- 2 · 2-8°C
Chemistry & industry
Suppliers9 total
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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