4-Tert-butyl-3-nitrobenzoic acid
4-tert-butyl-3-nitrobenzoic acid
Also Known As: 4-tert-butyl-3-nitrobenzoic acid|4-(tert-butyl)-3-nitrobenzoic acid|GERMANIUMSELENIDE|Maybridge1_005519|4-t-butyl-3-nitrobenzoic acid|Oprea1_211697|4-tert-Butyl-3-nitro-benzoic acid|DivK1c_001807|HMS557C19|4-TERT-BUTYL-3-NITROBENZOICACID|CDS1_000767|KM0337|BAS 02998948|Benzoic acid, 4-(1,1-dimethylethyl)-3-nitro-|AE-562/43286927|SR-01000643540-1|F2167-4296|106-782-0
| Molecular Formula | C11H13NO4 |
|---|---|
| Molecular Weight | 223.08446 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.08446 |
| Monoisotopic Mass | 223.08446 |
| Heavy Atoms | 16 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 60187-67-9 |
|---|---|
| SMILES | CC(C)(C)C1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-] |
| InChIKey | QIHHYQWNYKOHEV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Tert-butyl-3-nitrobenzoic acid (CAS 60187-67-9), with molecular formula C11H13NO4 and molecular weight 223.08446 g/mol. IUPAC: 4-tert-butyl-3-nitrobenzoic acid.
4-Tert-butyl-3-nitrobenzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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