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Basic information
- CAS
38120-06-8- Standard SMILES
CC(C)CCOC(=O)c1ccc([N+](=O)[O-])cc1- InChIKey
KMOODDWVCAWHMC-UHFFFAOYSA-N- Molecular formula
- C12H15NO4
- Average molar mass
- 237.255 g/mol
- Monoisotopic mass
- 237.10010796
Names & identifiers
- Preferred name
- Isopentyl 4-nitrobenzoate
- IUPAC
- 3-Methylbutyl 4-nitrobenzoate
- English name
- 3-Methylbutyl 4-nitrobenzoate
- Molecular formula
- C12H15NO4
- Molecular weight
- 237.25
Names & synonyms
isopentyl 4-nitrobenzoate3-Methylbutyl 4-nitrobenzoate4-Nitrobenzoic acid isopentyl ester1-Butanol, 3-methyl-, 1-(4-nitrobenzoate)
Database identifiers
- CAS
38120-06-8- PubChem CID
- 94875
- DTXSID
DTXSID70191530- UNII
- F8PXU2K9RP
- EC Number
- 253-788-5
- Nikkaji
- J195.906I
Properties
Physicochemical properties
- Boiling point
- 348.8 · 348.8±25.0 °C(Predicted)
- Density
- 1.154 · 1.154±0.06 g/cm3(Predicted)
- FDA UNII
- 8 PXU2K9RP · F8PXU2K9RP
Chemistry & industry
Applications
Uses3-Methylbutyl 4-Nitrobenzoate, has shown to be one of the aromatic nitro compounds possessing larvicidal activity. It can also be used as an intermediate in the synthesis of 3-Fluoro-3-methylButan-1-ol (F593630).
Suppliers5 total
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DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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