3-(N-メチル-N-ペンチルアミノ)プロピオン酸塩酸塩

3-(N-Methylpentylamino)propionic acid hydrochloride

HCID 16726423

基本情報

CAS
625120-81-2
標準SMILES
CCCCCN(C)CCC(=O)O.Cl
InChIKey
YDWXRULMHQZBEX-UHFFFAOYSA-N
分子式
C9H20ClNO2
平均分子量
209.71 g/mol
単同位体質量
209.1182566

名称と識別子

優先名称
3-(N-Methylpentylamino)propionic acid hydrochloride
IUPAC
3-[methyl(pentyl)amino]propanoic acid;hydrochloride
現地名
3-(N-メチル-N-ペンチルアミノ)プロピオン酸塩酸塩
英語名
3-(N-Methylpentylamino)propionic acid hydrochloride
分子式
C9H20ClNO2
分子量
209.71

名称と別名

3-(n-methylpentylamino)propionic acid hydrochlorideN-methyl-N-pentyl-beta-alanine hydrochlorideRefChem:495672613-046-7625120-81-23-(methyl(pentyl)amino)propanoic acid hydrochlorideIbanic Acid Hydrochloride3-[methyl(pentyl)amino]propanoic acid hydrochlorideMFCD082752163-(N-Methylpentylamino)propionic acid HCl3-[methyl(pentyl)amino]propanoic acid;hydrochloride3-(N-Methyl-N-pentylamino)propionic Acid Hydrochloride
名称をさらに表示
3-(N-メチル-N-ペンチルアミノ)プロピオン酸塩酸塩Ibandronate USP RC AIbandronic Impurity 2Ibandronate IntermediateIbandronate Related CoMpound A3-(N-MethylpentylaMino)propionicIbandronate Sodium Impurity 9 HClINTERMEDIATE OF IBANDRONATE SODIUM3-(N-methylpentylamino)propionic acidIbandronate USP Related Compound A HCl
E7FT72BUU1b-Alanine, N-methyl-N-pentyl-, hydrochloride3-(Methyl(pentyl)amino)propanoic acid HClEN300-6481907beta-Alanine, N-methyl-N-pentyl-, hydrochloride (1:1)Z1459932154.BETA.-ALANINE, N-METHYL-N-PENTYL-, HYDROCHLORIDE (1:1)YDWXRULMHQZBEX-UHFFFAOYSA-N

データベース識別子

CAS
625120-81-2
PubChem CID
16726423
DTXSID
DTXSID20587383
UNII
E7FT72BUU1
EC Number
613-046-7

物性

構造計算による物性

極性表面積
40.5 Ų
水素結合供与体数
2
水素結合受容体数
3
回転可能結合数
7
重原子数
13

物理化学的性質

融点
101 · 101-103°C
貯蔵温度
Sealed in dry,Room Temperature
溶解性
メタノール(微量)、水(微量)
外見
個体
色
ホワイトからオフホワイト
安定性
吸湿性

化学的性質

化学的特性White Solid

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 20% (1 of 5) of reports.

Danger

H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral];H314 (20%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H315 (60%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (20%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (40%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (40%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H341 (20%): Suspected of causing genetic defects [Warning Germ cell mutagenicity];H413 (20%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P203, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 5 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 5 reports by companies.;There are 4 notifications provided by 4 of 5 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

Hazard Classes and CategoriesAcute Tox. 4 (20%);Skin Corr. 1B (20%);Skin Irrit. 2 (60%);Skin Sens. 1 (20%);Eye Irrit. 2A (40%);STOT SE 3 (40%);Muta. 2 (20%);Aquatic Chronic 4 (20%)

安全データ

wgk
WGK 3
hs_code
2922498050
ストレージクラス
11 - Combustible Solids

化学と産業

応用分野

使用3-(N-Methylpentylamino)propionic acid hydrochloride is an intermediate in the preparation of biphosphonate drugs used in the prevention and treatment of osteoporosis.

サプライヤー100 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]

関連反応

2 件

化合物ノート

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