3-モルホリノプロピオン酸メチル

4-Morpholinepropanoic acid, methyl ester

HCID 101373

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 33611-43-7
標準SMILES: COC(=O)CCN1CCOCC1
InChIKey: YMSLLIGKMYXCPK-UHFFFAOYSA-N
分子式: C8H15NO3
平均分子量: 173.21 g/mol
単同位体質量: 173.10519334

名称と識別子

優先名称: 4-Morpholinepropanoic acid, methyl ester
IUPAC: methyl 3-morpholin-4-ylpropanoate
現地名: 3-モルホリノプロピオン酸メチル
英語名: METHYL 3-MORPHOLINOPROPIONATE
分子式: C8H15NO3
分子量: 173.21

名称と別名

4-Morpholinepropanoic acid, methyl esterMethyl 3-morpholinopropanoatemethyl 3-(morpholin-4-yl)propanoate4GK6TKD4AENSC 408953NSC-408953AI3-233123-morpholin-4-yl-propionic acid methyl esterDTXSID40677754-(2-(METHOXYCARBONYL)ETHYL)MORPHOLINERefChem:525785DTXCID4038716

名称をさらに表示

モルホリン-4-プロピオン酸メチル3-モルホリノプロパン酸メチル3-モルホリノプロピオン酸メチルモルホリン-4-プロパン酸メチルメチル 3-(モルホリン-4-イル)プロパノアートAKOS BB-87003-MORPHOLINYL METHYL PROPIONATEMethyl 3-morpholinopropiote, 98%METHYL 3-(N-MORPHOLINO)PROPIONATE

626-796-533611-43-7Methyl 4-morpholinepropionateMethyl 3-morpholinopropionatemethyl 3-morpholin-4-ylpropanoateMFCD00023391Methyl 3-(4-morpholinyl)propanoatemethyl-3-morpholinopropionate

データベース識別子

CAS: 33611-43-7
PubChem CID: 101373
DTXSID: DTXSID4067775
ChEMBL: CHEMBL1195667
UNII: 4GK6TKD4AE
EC Number: 626-796-5
Nikkaji: J69.005H

物性

構造計算による物性

XLogP: -0.3
極性表面積: 38.8 Å²
水素結合供与体数: 0
水素結合受容体数: 4
回転可能結合数: 4
重原子数: 12
形式電荷: 0
複雑度: 143

物理化学的性質

沸点: 82 °C2 · 82 °C2 mm Hg(lit.)
比重(密度): 1.068 g/mL · 1.068 g/mL at 25 °C(lit.)
屈折率: 20 · n20/D 1.459(lit.)
闪点: 220 °F · 220 °F
酸解離定数(Pka): 5.98 · 5.98±0.10(Predicted)
比重: 1.06 · 1.06
CAS データベース: 33611 · 33611-43-7(CAS DataBase Reference)
EPAの化学物質情報: 4 · 4-Morpholinepropanoic acid, methyl ester (33611-43-7)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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 CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

安全データ

wgk: 3
tsca: TSCA listed
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36

化学と産業

用途と製造

General Manufacturing Information4-Morpholinepropanoic acid, methyl ester: INACTIVE

応用分野

使用Methyl 3-Morpholin-4-ylpropanoate is used in method for preparation steric hindrance adjustable weak base light stabilizers with effective light stability and antioxidation stability protection for polymer material.