1-メチルピペラジン

1-Methylpiperazine

HCID 53167CAS 109-01-3

基本情報

標準SMILES
CN1CCNCC1
InChIKey
PVOAHINGSUIXLS-UHFFFAOYSA-N
分子式
C5H12N2
平均分子量
100.16 g/mol
単同位体質量
100.10004839

名称と識別子

優先名称
1-Methylpiperazine
IUPAC
1-methylpiperazine
現地名
1-メチルピペラジン
英語名
1-Methylpiperazine
分子式
C5H12N2
分子量
100.16

名称と別名

1-MethylpiperazineN-Methylpiperazine109-01-3PIPERAZINE, 1-METHYL-1-methyl piperazineB92I95EL9QNSC-30195NSC-30675DTXSID4021898RefChem:434645DTXCID601898CHEBI:46920
名称をさらに表示
1-メチルピペラジン4-メチルピペラジンN-メチルピペラジン1‐メチルピペラジンNMPRZ1-MethyipiperazineN-MethylpiperazinPiperazine,1-methyl-CL046AKOS BBS-000036651-methyl-piperazin
203-639-54-Methylpiperazinen-methyl piperazine1-Methyl-piperazineMETHYLPIPERAZINEmethyl piperazineN-METHYL-PIPERAZINE1-methylpyperazine

データベース識別子

CAS
109-01-3
PubChem CID
53167
DTXSID
DTXSID4021898
ChEMBL
CHEMBL1011
ChEBI
CHEBI:166561
UNII
B92I95EL9Q
EC Number
203-639-5
Nikkaji
J1.011A

物性

構造計算による物性

XLogP
-0.4
極性表面積
15.3 Ų
水素結合供与体数
1
水素結合受容体数
2
回転可能結合数
0
重原子数
7

実験および物理化学的性質

Vapor Pressure3.0 [mmHg]
Physical DescriptionClear light yellow hygroscopic liquid; [Sigma-Aldrich MSDS]
Kovats Retention Index · 2 件

839;847;852;838.5

1266;1270;1274;1282;1282;1286;1262

物理化学的性質

融点
-6 °C · -6 °C
沸点
138 °C · 138 °C(lit.)
比重(密度)
0.903 g/mL · 0.903 g/mL at 25 °C(lit.)
蒸気密度
3.5 · 3.5 (vs air)
蒸気圧
12 hPa · 12 hPa (20 °C)
屈折率
20 · n20/D 1.466(lit.)

化学的性質

化学的特性clear liquid

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 1.1% (4 of 377) of reports.

Danger

H226 (98.7%): Flammable liquid and vapor [Warning Flammable liquids];H312 (44.8%): Harmful in contact with skin [Warning Acute toxicity, dermal];H314 (98.9%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H317 (53.8%): May cause an allergic skin reaction [Warning Sensitization, Skin];H318 (51.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H330 (24.4%): Fatal if inhaled [Danger Acute toxicity, inhalation];H331 (12.5%): Toxic if inhaled [Danger Acute toxicity, inhalation];H332 (56.8%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P272, P280, P284, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P320, P321, 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 377 reports by companies from 24 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 4 of 377 reports by companies.;There are 23 notifications provided by 373 of 377 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 · 4 件

Chemical: Piperazine, 1-methyl-

Status: Active Update: 08-07-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13739;Status: Active Update: 20-10-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/18323

1-Methylpiperazine: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

Hazards Summary · 1 件

Causes skin corrosion in acute dermal studies of rabbits; Causes convulsions in acute inhalation studies of mice; Causes multiple liver effects, changes in renal tubules, changes in recording from peripheral motor nerve, and general anesthesia in acute oral studies of mice; [RTECS] Causes burns; May cause skin sensitization; Harmful by inhalation; [ECHA REACH Registrations] Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Harmful by skin absorption; Toxic by inhalation; [Sigma-Aldrich MSDS] See Piperazine and salts.

Hazard Classes and Categories · 2 件

Flam. Liq. 3 (98.7%);Acute Tox. 4 (44.8%);Skin Corr. 1B (98.9%);Skin Sens. 1B (53.8%);Eye Dam. 1 (51.7%);Acute Tox. 1 (24.4%);Acute Tox. 3 (12.5%);Acute Tox. 4 (56.8%)

Corrosives, Flammable agents - 2nd degree

毒性情報

Adverse Effects · 1 件

Occupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.;Dermatotoxin - Skin burns.;Skin Sensitizer - An agent that can induce an allergic reaction in the skin.;Toxic Pneumonitis - Inflammation of the lungs induced by inhalation of metal fumes or toxic gases and vapors.

Toxicity DataLC50 (mouse) = 2,740 mg/m3/2hr

法規制情報

Regulatory Information · 4 件

Chemical: Piperazine, 1-methyl-

Status: Active Update: 08-07-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13739;Status: Active Update: 20-10-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/18323

1-Methylpiperazine: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

安全データ

wgk
2
tsca
TSCA listed
rtecs
TM1225000
ridadr
UN 2734 8/PG 2
毒性
LD50 orally in Rabbit: 2547 mg/kg LD50 dermal Rabbit 1341 mg/kg
hs_code
29335995

化学と産業

用途と製造

UsesUsed to make large scale and fine chemicals; [ECHA REACH Registrations]
General Manufacturing InformationPiperazine, 1-methyl-: ACTIVE

応用分野

使用1-Methylpiperazine is used in the preparation of 2-(4-Methyl-1-piperazinylmethyl)acrylophenone(MPMAP)

上流・下流製品情報

下流製品

AZIMILIDE3-(4-メチル-1-ピペラジニル)アニリン2-(4-Methylpiperazin-1-yl)pyrimidine-5-carbaldehyde2-(4-Methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidine-4-carbonitrile1-アミノ-4-メチルピペラジンゾピクロン1-メチルピペラジン二塩酸塩2-(4-Methylpiperazin-1-yl)pyrimidine-5-carbonyl chloride2-(4-Methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidine-4-carboxamide(2-(4-Methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-4-yl)methanamine3-(4-メチルピペラジン-1-イルメチル)安息香酸2-(4-Methylpiperazin-1-yl)pyrimidine-5-carboxylic acid

サプライヤー50 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

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