diethyl 5-nitroisophthalate (CAS 10560-13-1) — formula C12H13NO6, molecular weight 267.23; category organic chemicals.
| CAS Number | 10560-13-1 |
|---|---|
| Molecular Formula | C12H13NO6 |
| Molecular Weight | 267.23 |
| LogP | 2.2 |
| Category | Organic Chemicals |
diethyl 5-nitroisophthalate is a carbon-based organic compound with CAS registry number 10560-13-1 and molecular formula C12H13NO6 (molecular weight 267.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 10560-13-1
Its molecular formula C12H13NO6 comprises 12 C, 13 H, 1 N, 6 O atoms.
Also known as: diethyl 5-nitroisophthalate · 5-硝基间苯二甲酸二乙酯
Category: organic chemicals
The CAS registry number of diethyl 5-nitroisophthalate is 10560-13-1.
Molecular formula C12H13NO6, molecular weight 267.23.
It is also registered under: diethyl 5-nitroisophthalate, 5-硝基间苯二甲酸二乙酯.
Category: Organic Chemicals.
Independent reference data for diethyl 5-nitroisophthalate (CAS 10560-13-1), compiled from public chemistry databases.
| CAS Registry Number | 10560-13-1 |
|---|---|
| PubChem CID | 82726 |
| Molecular formula | C12H13NO6 |
| IUPAC name | diethyl 5-nitrobenzene-1,3-dicarboxylate |
| UNII (FDA) | NS00051974 |
| Molecular Weight | 267.23 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 267.07428713 |
| Monoisotopic Mass | 267.07428713 |
| Topological Polar Surface Area | 98.4 |
| Heavy Atom Count | 19 |
Diethyl 5-nitroisophthalate; EINECS 234-144-2; RefChem:587177; 234-144-2; 10560-13-1; Diethyl5-nitroisophthalate; diethyl 5-nitrobenzene-1,3-dicarboxylate; 1,3-Diethyl 5-nitro-1,3-benzenedicarboxylate; 1,3-Benzenedicarboxylicacid, 5-nitro-, 1,3-diethyl ester; SCHEMBL8076355; DTXSID40909624; PYBFOSCCWZPUSC-UHFFFAOYSA-N; AKOS015888935; DB-040637; NS00051974; 5-NITRO-ISOPHTHALIC ACID DIETHYL ESTER
| Reported hazard statements | H302 (97.4%) |
|---|
H302 (97.4%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
diethyl 5-nitroisophthalate · CAS 10560-13-1 · C12H13NO6. UNII NS00051974.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5-硝基间苯二甲酸二乙酯