1-(ピペリジン-1-イル)-1-(フェニル)シクロヘキサン
フェンシクリジン · エンゼルダスト · PCP【麻酔薬】 · フェンシクリン · 1-(1-フェニルシクロヘキシル)ピペリジン · 1-フェニル-1-ピペリジノシクロヘキサン · フェンサイクリジン · 1-(ピペリジン-1-イル)-1-(フェニル)シクロヘキサン

識別子と物理属性
| CAS No. | 77-10-1 |
|---|---|
| 分子式 | C17H25N |
| 平均分子量 | 243.4 g/mol |
| 単同位体質量 | 243.1986998 g/mol |
| SMILES | c1ccc(C2(N3CCCCC3)CCCCC2)cc1 |
| InChIKey | JTJMJGYZQZDUJJ-UHFFFAOYSA-N |
| PubChem CID | 6468 |
| ChEMBL | CHEMBL275528 |
| ChEBI | CHEBI:8058 |
| EC No. | 621-588-0 |
| DTXSID | DTXSID6023446 |
| 現地名 | 1-(ピペリジン-1-イル)-1-(フェニル)シクロヘキサン |
化学・物理的性質
| XLogP | 3.6 |
|---|---|
| 極性表面積 | 3.2 |
| 水素結合供与体数 | 0 |
| 水素結合受容体数 | 1 |
| 回転可能結合数 | 2 |
| 重原子数 | 18 |
| 形式電荷 | 0 |
| 複雑度 | 242 |
| 医薬品 | DEA NFLIS-Drug Category -> Depressants and TranquilizersDEA Schedule II Controlled Substance -> DepressantsPharmaceuticals -> Synthetic Cannabinoids or Psychoactive CompoundsPharmaceuticals -> Listed in ZINC15 |
| LogP(分配係数) | log Kow = 4.69 (ion-corrected average)5.74 |
| 臭い | Oily, slightly ammoniac |
| Color/Form | White, crystalline powderOn the street may contain a number of contaminants causing the color to range from tan to brown with a consistency ranging from powder to a gummy massColorless crystalsWhite crystalline powder |
| 溶解度 | Soluble in ethanol |
| Human Drugs | Breast FeedingLactationMilk, HumanExcitatory Amino Acid AntagonistsHallucinogensStreet DrugsPharmaceuticals |
| 沸点 | BP: 136 °C at 1.0 mm Hgbp1.0 135-137° |
| Decomposition | When heated to decomposition it emits toxic fumes of /nitrogen oxides/. |
| 融点 | 46.5 °C46.5℃ |
| Stability/Shelf Life | Stable under recommended storage conditions. /Phencyclidine hydrochloride/ |
| Dissociation Constants | 8.29pKa = 8.29 |
| Other Experimental Properties | Phencyclidine belongs to a unique family of chemicals called cyclohexylamines.Crystals, mp 243-244 °C /Phencyclidine hydrochloride/The majority of illicitly synthesized compounds are nitrogen-substituted. Small chain alkyl groups (eg, ethyl, propyl) have been the most common substitution ... /PCP analogs/Crystals, mp 214-218 °C /Phencyclidine hydrobromide/ |
| 密度 | 0.9762 (rough estimate) |
| 屈折率 | 1.5000 (estimate) |
| 引火点 | 11 °C |
| 貯蔵条件 | −20°C |
| 外観・状態 | liquid |
| pKa(酸解離定数) | pKa 8.5 (Uncertain) |
| 色 | 無色の結晶 |
| 由来生物 | human |
| ヘンリー定数 | 1.8×100 mol/(m3Pa) at 25℃, HSDB (2015) |
| 主な用途 | 法医学と毒物学 |
| InChI | 1S/C17H25N/c1-4-10-16(11-5-1)17(12-6-2-7-13-17)18-14-8-3-9-15-18/h1,4-5,10-11H,2-3,6-9,12-15H2 |
| InChIKey | JTJMJGYZQZDUJJ-UHFFFAOYSA-N |
| SMILES | N3(CCCCC3)C2(CCCCC2)c1ccccc1 |
| EPAの化学物質情報 | Piperidine, 1-(1-phenylcyclohexyl)- (77-10-1) |
安全性と法規制
| GHS 分類 | DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P316, P321, P330, P361+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.H301: Toxic if swallowed [Danger Acute toxicity, oral] |
|---|---|
| 規制情報 | DEA schedule II controlled substancePiperidine, 1-(1-phenylcyclohexyl)-: Does not have an individual approval but may be used under an appropriate group standard |
| FDA 要件 | Schedule II shall consist of the drugs and other substances, by whatever official name, common or usual name, chemical name, or brand name designated, listed in this section. Each drug or substance has been assigned the DEA Controlled Substances Code Number set forth opposite it. ... Unless specifically excepted or unless listed in another schedule, any material, compound, mixture, or preparation which contains any quantity of the following substances having a depressant effect on the central nervous system, including its salts, isomers, and salts of isomers whenever the existence of such salts, isomers, and salts of isomers is possible within the specific chemical designation. Phencyclidine (DEA Code Number: 7471) is included on this list.Schedule I shall consist of the drugs and other substances, by whatever official name, common or usual name, chemical name, or brand name designated, listed in this section. Each drug or substance has been assigned the DEA Controlled Substances Code Number set forth opposite it. ... Unless specifically excepted or unless listed in another schedule, any material, compound, mixture, or preparation, which contains any quantity of the following hallucinogenic substances, or which contains any of its salts, isomers, and salts of isomers whenever the existence of such salts, isomers, and salts of isomers is possible within the specific chemical designation (for purposes of this paragraph only, the term "isomer" includes the optical, position and geometric isomers). Ethylamine analog of phencyclidine (DEA Code Number: 7455) is included on this list. /Ethylamine analog of phencyclidine/Schedule I shall consist of the drugs and other substances, by whatever official name, common or usual name, chemical name, or brand name designated, listed in this section. Each drug or substance has been assigned the DEA Controlled Substances Code Number set forth opposite it. ... Unless specifically excepted or unless listed in another schedule, any material, compound, mixture, or preparation, which contains any quantity of the following hallucinogenic substances, or which contains any of its salts, isomers, and salts of isomers whenever the existence of such salts, isomers, and salts of isomers is possible within the specific chemical designation (for purposes of this paragraph only, the term "isomer" includes the optical, position and geometric isomers). Pyrrolidine analog of phencyclidine (DEA Code Number: 7458) is included on this list. /Pyrrolidine analog of phencyclidine/ |
用途
使用
Anesthetic.
一般的な説明
Phencyclidine was introduced as a dissociative anestheticfor animals. Its close structural relative ketamine is still soused and may be used in humans. In humans,PCP produces a sense of intoxication, hallucinogenic experiencesnot unlike those produced by the anticholinergic hallucinogens,and often, amnesia.The drug affects many systems, including those of NE,DA, and 5-HT. It has been proposed that PCP (and certainother psychotomimetics) produces a unique pattern of activationof ventral tegumental area dopaminergic neurons.Itblocks glutaminergic N-methyl-D-aspartate receptors.Thisaction is the basis for many of its CNS effects. PCP itself appearsto be the active agent. The psychotic state produced bythis drug is also cited as a better model than amphetaminepsychosis for the psychotic state of schizophrenia.