Ethyl 3-nitrobenzoate (CAS 618-98-4) — formula C9H9NO4, molecular weight 195.17; category organic chemicals.
| CAS Number | 618-98-4 |
|---|---|
| Molecular Formula | C9H9NO4 |
| Molecular Weight | 195.17 |
| LogP | 2.35 |
| Applications | General Manufacturing Information: Benzoic acid, 3-nitro-, ethyl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Benzoic acid, 3-nitro-, ethyl ester: ACTIVE.
Ethyl 3-nitrobenzoate is a carbon-based organic compound with CAS registry number 618-98-4 and molecular formula C9H9NO4 (molecular weight 195.17), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 618-98-4
Its molecular formula C9H9NO4 comprises 9 C, 9 H, 1 N, 4 O atoms.
Also known as: Ethyl 3-nitrobenzoate · 3-硝基苯甲酸乙酯
Category: organic chemicals
The CAS registry number of Ethyl 3-nitrobenzoate is 618-98-4.
Molecular formula C9H9NO4, molecular weight 195.17.
It is also registered under: Ethyl 3-nitrobenzoate, 3-硝基苯甲酸乙酯.
Recorded applications: General Manufacturing Information: Benzoic acid, 3-nitro-, ethyl ester: ACTIVE.
Category: Organic Chemicals.
Independent reference data for Ethyl 3-nitrobenzoate (CAS 618-98-4), compiled from public chemistry databases.
| CAS Registry Number | 618-98-4 |
|---|---|
| PubChem CID | 69261 |
| Molecular formula | C9H9NO4 |
| IUPAC name | ethyl 3-nitrobenzoate |
| UNII (FDA) | NS00034837 |
| Molecular Weight | 195.17 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 195.05315777 |
| Monoisotopic Mass | 195.05315777 |
| Topological Polar Surface Area | 72.1 |
| Heavy Atom Count | 14 |
| LogP | 2.35 |
|---|
Ethyl 3-nitrobenzoate; Ethyl m-nitrobenzoate; Benzoic acid, 3-nitro-, ethyl ester; Ethyl-m-nitrobenzoate; NSC 6762; EINECS 210-574-6; NSC 32740; AI3-02745; DTXSID0060692; RefChem:138713; DTXCID4043143; 210-574-6; InChI=1/C9H9NO4/c1-2-14-9(11)7-4-3-5-8(6-7)10(12)13/h3-6H,2H2,1H; MKBIJCPQTPFQKQ-UHFFFAOYSA-N; 618-98-4; m-Nitrobenzoic acid, ethyl ester
Ethyl 3-nitrobenzoate · CAS 618-98-4 · C9H9NO4. UNII NS00034837. LogP: 2.35.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-硝基苯甲酸乙酯