氯菌酸(CAS 115-28-6):分子式 C9H4Cl6O4、分子量 388.8。
| CAS号 | 115-28-6 |
|---|---|
| 分子式 | C9H4Cl6O4 |
| 分子量 | 388.8 |
| 熔点 | 406 to 410 °F (NTP, 1992) |
| LogP | log Kow= 2.30 |
氯菌酸 是一种化工化合物,登记 CAS 号为 115-28-6,分子式 C9H4Cl6O4(分子量 388.8)。
登记 CAS 号:115-28-6
其分子式 C9H4Cl6O4 由 9 个碳、4 个氢、6 个氯、4 个氧 组成。
别名/同义词:氯菌酸 · Chlorendic acid
氯菌酸 的 CAS 登记号为 115-28-6。
分子式 C9H4Cl6O4,分子量 388.8。
别名/同义词:氯菌酸、Chlorendic acid。
氯菌酸(CAS 115-28-6)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 115-28-6 |
|---|---|
| PubChem CID | 8266 |
| Molecular formula | C9H4Cl6O4 |
| IUPAC name | 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid |
| UNII (FDA) | IAC1H0N39L |
| Molecular Weight | 388.8 |
|---|---|
| XLogP3 | 2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 387.821125 |
| Monoisotopic Mass | 385.824075 |
| Topological Polar Surface Area | 74.6 |
| Heavy Atom Count | 19 |
| Melting Point | 406 to 410 °F (NTP, 1992) |
|---|---|
| Solubility | In water, 0.35 g/100 g @ 25 °C |
| Vapor Pressure | 0.00000003 [mmHg] |
| Vapor Pressure | 1.4X10-8 mm Hg @ 25 °C /Estimated/ |
| LogP | log Kow= 2.30 |
| Dissociation Constants | pKa=3.1 |
CHLORENDIC ACID; 115-28-6; 1,4,5,6,7,7-Hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid; HET acid; Kyselina het; Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-; NCI-C55072; Hexachloroendomethylenetetrahydrophthalic acid; DTXSID2020268; 1,4,5,6,7,7-Hexachloro-5-norbornene-2,3-dicarboxylic acid; Hexachloro-endo-methylenetetrahydrophthalic acid; 5-Norbornene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-; 1,4,5,6,7,7-Hexachloro-8,9,10-trinorborn-5-ene-2,3-dicarboxylic acid; 1,4,5,6,7,7-Hexachlorobicyclo(2.2.1)-5-heptene-2,3-dicarboxylic acid; DTXCID80268; CHEBI:76603
| Reported hazard statements | H315 (74.2%), H318 (16.2%), H319 (82.7%), H335 (73.8%), H350 (74.2%), H351 (16.2%), H302, H330 |
|---|
H315 (74.2%): Causes skin irritation [Warning Skin corrosion/irritation]
H318 (16.2%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Chlorendic acid · CAS 115-28-6 · C9H4Cl6O4. UNII IAC1H0N39L. Melting Point: 406 to 410 °F (NTP, 1992); Solubility: In water, 0.35 g/100 g @ 25 °C; Vapor Pressure: 0.00000003 [mmHg].
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: Chlorendic acid