3-Cyano-4-isopropoxybenzoic acid (CAS 258273-31-3) — formula C11H11NO3, molecular weight 205.21; category organic chemicals.
| CAS Number | 258273-31-3 |
|---|---|
| Molecular Formula | C11H11NO3 |
| Molecular Weight | 205.21 |
| LogP | 1.9 |
| Category | Organic Chemicals |
3-Cyano-4-isopropoxybenzoic acid is a carbon-based organic compound with CAS registry number 258273-31-3 and molecular formula C11H11NO3 (molecular weight 205.21), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 258273-31-3
Its molecular formula C11H11NO3 comprises 11 C, 11 H, 1 N, 3 O atoms.
Also known as: 3-Cyano-4-isopropoxybenzoic acid · 3-氰基-4-异丙氧基苯甲酸
Category: organic chemicals
The CAS registry number of 3-Cyano-4-isopropoxybenzoic acid is 258273-31-3.
Molecular formula C11H11NO3, molecular weight 205.21.
It is also registered under: 3-Cyano-4-isopropoxybenzoic acid, 3-氰基-4-异丙氧基苯甲酸.
Category: Organic Chemicals.
Independent reference data for 3-Cyano-4-isopropoxybenzoic acid (CAS 258273-31-3), compiled from public chemistry databases.
| CAS Registry Number | 258273-31-3 |
|---|---|
| PubChem CID | 21956832 |
| Molecular formula | C11H11NO3 |
| IUPAC name | 3-cyano-4-propan-2-yloxybenzoic acid |
| UNII (FDA) | 6HGE0YD4NJ |
| Molecular Weight | 205.21 |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 205.07389321 |
| Monoisotopic Mass | 205.07389321 |
| Topological Polar Surface Area | 70.3 |
| Heavy Atom Count | 15 |
3-cyano-4-isopropoxybenzoic acid; 258273-31-3; 6HGE0YD4NJ; 3-Cyano-4-(1-methylethoxy)benzoic acid; 3-cyano-4-isopropyloxybenzoic acid; RP-101124; RP101124; 3-Cyano-4-((1-methylethyl)oxy)benzoic acid; Benzoic acid, 3-cyano-4-(1-methylethoxy)-; 3-cyano-4-[(1-methylethyl)oxy]benzoic acid; RefChem:883881; 813-640-8; 3-cyano-4-propan-2-yloxybenzoic acid; 3-Cyano-4-isopropoxy-benzoic acid; MFCD09271830; 3-cyano-4-(propan-2-yloxy)benzoic acid
| Reported hazard statements | H302 (100%), H312 (33.3%), H315 (33.3%), H318 (33.3%), H319 (33.3%), H332 (33.3%), H335 (66.7%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]
3-Cyano-4-isopropoxybenzoic acid · CAS 258273-31-3 · C11H11NO3. UNII 6HGE0YD4NJ.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-氰基-4-异丙氧基苯甲酸