Cyclopentylamine (HCID 2906)

名称と識別子

優先名称: Cyclopentylamine
IUPAC: cyclopentanamine
現地名: シクロペンチルアミン
英語名: Cyclopentylamine
分子式: C5H11N
分子量: 85.15

名称と別名

CyclopentylamineCyclopentanamine1003-03-8Aminocyclopentane4259VRY3GNNSC-32389DTXSID4061387RefChem:581096DTXCID2032506213-697-3MFCD00001380Amino cyclopentane

名称をさらに表示

シクロペンチルアミン1-アミノシクロペンタン1-シクロペンタンアミンシクロペンタン-1-アミンアミノシクロペンタンシクロペンタンアミンシクロペンチルアミン, 99%Cyclopentylamine,Aminocyclopentanecb1689Ring aMylaMineAKOS BBS-00003621cychlopentylamineAMINOCYCLAOPENTANE1-Cyclopentanamine

Cyclopentanamine; Aminocyclopentane; NSC 32389EINECS 213-697-3NSC 32389CB 1689BRN 0635706UNII-4259VRY3GNcylcopentylaminecyclopentyl amine

データベース識別子

CAS: 1003-03-8
PubChem CID: 2906
DTXSID: DTXSID4061387
ChEMBL: CHEMBL1171859
UNII: 4259VRY3GN
EC Number: 213-697-3
Nikkaji: J13.547J

物性

構造計算による物性

XLogP: 0.6
極性表面積: 26 Å²
水素結合供与体数: 1
水素結合受容体数: 1
回転可能結合数: 0
重原子数: 6
形式電荷: 0
複雑度: 37

物理化学的性質

融点: -85 °C · -85°C
沸点: 106 · 106-108 °C(lit.)
比重(密度): 0.863 g/mL · 0.863 g/mL at 25 °C(lit.)
蒸気圧: 26.72 hPa · 26.72hPa at 20℃
屈折率: 20 · n20/D 1.450(lit.)
闪点: 63 °F · 63 °F
貯蔵温度: Flammables area
外見: 液体
酸解離定数(Pka): 1 · pK1:10.65(+1) (25°C)
色: クリア
爆発限界(explosive limit): 1.3 · 1.3-9.40%(V)
水溶解度: 混和性
比熱容量: 2.13 J/ · Cp(liquid): 2.13 J/(g·K), at 25℃
BRN: 635706 · 635706
InChI: 1S/C5H11N/c6-5-3-1-2-4-5/h5H,1-4,6H2
InChIKey: NISGSNTVMOOSJQ-UHFFFAOYSA-N
SMILES: NC1CCCC1
LogP: 0.83 at · 0.83 at 20℃
CAS データベース: 1003 · 1003-03-8(CAS DataBase Reference)
NISTの化学物質情報: Cyclopentanamine(1003-03-8)
EPAの化学物質情報: Cyclopentanamine (1003-03-8)

化学的性質

化学的特性a colorless liquid with an ammoniacal odor.

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 0.6% (1 of 154) of reports.

Danger

H225 (99.4%): Highly Flammable liquid and vapor [Danger Flammable liquids]；H300 (97.4%): Fatal if swallowed [Danger Acute toxicity, oral]；H314 (74.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (25.3%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (31.2%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H318 (94.2%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H331 (69.5%): Toxic if inhaled [Danger Acute toxicity, inhalation]；H332 (26.6%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H412 (68.8%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P332+P317, P333+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 154 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 1 of 154 reports by companies.；There are 9 notifications provided by 153 of 154 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Regulatory Information · 2 件

Status: Active Update: 28-08-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/7046；Status: Active Update: 29-01-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/10145

Cyclopentylamine: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 2 (99.4%)；Acute Tox. 2 (97.4%)；Skin Corr. 1B (74.7%)；Skin Irrit. 2 (25.3%)；Skin Sens. 1 (31.2%)；Eye Dam. 1 (94.2%)；Acute Tox. 3 (69.5%)；Acute Tox. 4 (26.6%)；Aquatic Chronic 3 (68.8%)

法規制情報

Regulatory Information · 2 件

Status: Active Update: 28-08-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/7046；Status: Active Update: 29-01-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/10145

Cyclopentylamine: Does not have an individual approval but may be used under an appropriate group standard

安全データ

F: 8-10-23
wgk: 3
tsca: TSCA listed
rtecs: GY8452000
ridadr: UN 2733 3/PG 2
hs_code: 29213099
risk_code: 11-37/38-43-34-25-20
消防法: 危-4-1-II
hazard_code: F,Xi,T
safety_code: 16-45-36/37/39-25-26
hazard_class: 3
packing_group: II
Hazard Classifications: Acute Tox. 2 OralAcute Tox. 3 InhalationAquatic Chronic 3Eye Dam. 1Flam. Liq. 2Skin Corr. 1BSkin Sens. 1
ストレージクラス: 3 - Flammable liquids

化学と産業

用途と製造

General Manufacturing InformationCyclopentanamine: ACTIVE

応用分野 · 1 件

使用Cyclopentylamine acts as an important raw material and intermediate used in organic synthesis and pharmaceuticals. Further, it serves as chemokine receptor 2 antagonists. It acts as a ligand in coordination chemistry and forms cis-dichlorobis(cyclopentylamine)platinum(II) complex.

調製方法 · 2 件

製造方法Cyclopentylamine is produced from cyclopentanone and ammonia over nickel catalysts at 20 MPa and 150 – 200℃ in the presence of circulating hydrogen over a fixedbed catalyst.

純化方法The amine may contain H2O or CO2 in the form of carbamate salt. Dry it over KOH pellets and then distil it from a few pellets of KOH. Store it in a dark, dry CO2-free atmosphere. It is characterised as the thiocyanate salt m 94.5o. The benzenesulfonyl derivative has m 68.5-69.5o. [Roberts & Chambers J Am Chem Soc 73 5030 1951, Bollinger et al. J Am Chem Soc 75 1729 1953, Beilstein 12 IV 4.]