2-chloro-2-nitropropane (CAS 594-71-8) — formula C3H6ClNO2, molecular weight 123.54; category organic chemicals.
| CAS Number | 594-71-8 |
|---|---|
| Molecular Formula | C3H6ClNO2 |
| Molecular Weight | 123.54 |
| Boiling Point | 134 °C (DECOMPOSES) |
| LogP | 1.3 |
| Category | Organic Chemicals |
2-chloro-2-nitropropane is a carbon-based organic compound with CAS registry number 594-71-8 and molecular formula C3H6ClNO2 (molecular weight 123.54), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 594-71-8
Its molecular formula C3H6ClNO2 comprises 3 C, 6 H, 1 Cl, 1 N, 2 O atoms.
Also known as: 2-chloro-2-nitropropane · 2-氯-2-硝基丙烷
Category: organic chemicals
The CAS registry number of 2-chloro-2-nitropropane is 594-71-8.
Molecular formula C3H6ClNO2, molecular weight 123.54.
It is also registered under: 2-chloro-2-nitropropane, 2-氯-2-硝基丙烷.
Category: Organic Chemicals.
Independent reference data for 2-chloro-2-nitropropane (CAS 594-71-8), compiled from public chemistry databases.
| CAS Registry Number | 594-71-8 |
|---|---|
| PubChem CID | 11673 |
| Molecular formula | C3H6ClNO2 |
| IUPAC name | 2-chloro-2-nitropropane |
| UNII (FDA) | 47BO4I4HL2 |
| Molecular Weight | 123.54 |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 123.0087061 |
| Monoisotopic Mass | 123.0087061 |
| Topological Polar Surface Area | 45.8 |
| Heavy Atom Count | 7 |
| Boiling Point | 134 °C (DECOMPOSES) |
|---|---|
| Flash Point | 135 °F (NTP, 1992) |
| Flash Point | 57 °C |
| Flash Point | 135 °F (57 °C) (OPEN CUP) |
| Solubility | 0.5 ML SOL IN 100 ML WATER @ 20 °C |
| Density | 1.230 g/cu cm @ 19 °C |
| Vapor Density | 4.3 (AIR= 1) |
| Vapor Pressure | 22.3 mmHg at 77 °F (NTP, 1992) |
| Vapor Pressure | 8.5 [mmHg] |
| Vapor Pressure | 8.5 MM HG @ 25 °C |
2-CHLORO-2-NITROPROPANE; 594-71-8; Propane, 2-chloro-2-nitro-; 2-chloro-2-nitro-propane; DTXSID7024798; 47BO4I4HL2; NSC-3642; CCRIS 5998; HSDB 1407; NSC 3642; EINECS 209-853-5; UNII-47BO4I4HL2; AI3-15635; NSC3642; WLN: WNXG1&1; MLS002454363
| Reported hazard statements | H226 (100%), H302 (100%), H319 (100%) |
|---|
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
2-chloro-2-nitropropane · CAS 594-71-8 · C3H6ClNO2. UNII 47BO4I4HL2. Boiling Point: 134 °C (DECOMPOSES); Flash Point: 135 °F (NTP, 1992); Flash Point: 57 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-氯-2-硝基丙烷