CAS 135270-08-5 (2R)-1-morpholino-2-((tetrahydro-2H-pyran-2-yl)oxy)propan-1-one (HCID 10977653)

名称と識別子

優先名称: (2R)-1-morpholino-2-((tetrahydro-2H-pyran-2-yl)oxy)propan-1-one
IUPAC: (2R)-1-morpholin-4-yl-2-(oxan-2-yloxy)propan-1-one
英語名: 4-[(2R)-2-(3,4,5,6-tetrahydro-2H-pyran-2-yloxy)-propionyl]morpholine
分子式: C12H21NO4
分子量: 243.3

名称と別名

(2R)-1-Morpholino-2-((tetrahydro-2H-pyran-2-yl)oxy)propan-1-one4-[(2R)-1-Oxo-2-[(tetrahydro-2H-pyran-2-yl)oxy]propyl]morpholine4-((2R)-1-Oxo-2-((tetrahydro-2H-pyran-2-yl)oxy)propyl)morpholineRefChem:396867819-998-1135270-08-5(2R)-1-morpholin-4-yl-2-(oxan-2-yloxy)propan-1-oneSCHEMBL4909056ANFZGSBFEPFDNR-NFJWQWPMSA-NDTXSID701170835(2R)-1-Morpholino-2-(tetrahydro-2h-pyran-2-yloxy)propan-1-oneMFCD20271359

名称をさらに表示

Efluconazole impurity 34Efinaconazole Impurity 7(Mixture of Diastereomers)Efinaconazole Impurity 25 (Mixture of Diastereomers)Morpholine, 4-[(2R)-1-oxo-2-[(tetrahydro-2H-pyran-2-yl)oxy]p...Morpholine, 4-[(2R)-1-oxo-2-[(tetrahydro-2H-pyran-2-yl)oxy]propyl]-4-[(2R)-2-(3,4,5,6-tetrahydro-2H-pyran-2-yloxy)-propionyl]morpholine4- [(2R) -1-oxo-2- [(tetrahydro-2H-pyran-2-yl) oxy] propyl] morpholine(2R)-1-MORPHOLINO-2-(TETRAHYDRO-2H-PYRAN-2-YLOXY)PROPAN-1-ONE(WXG00767)

SY348593CS-0445174(2R)-1-(Morpholin-4-yl)-2-[(oxan-2-yl)oxy]propan-1-one1-Morpholin-4-yl-2-(tetrahydro-pyran-2-yloxy)-propan-1-one(2R)-1-Morpholino-2-[(tetrahydro-2H-pyran-2-yl)oxy]-1-propanone4-[(2R)-2-(3,4,5,6-tetrahydro-2H-pyran-2-yloxy) propionyl]morpholine4-[(2R)-2-(3,4,5,6-tetrahydro-2H-pyran-2-yloxy)propionyl] morpholine4-[(2R)-2-(3,4,5,6-tetrahydro-2H-pyran-2-yloxy)propionyl]morpholine

データベース識別子

CAS: 135270-08-5
PubChem CID: 10977653
DTXSID: DTXSID701170835
EC Number: 819-998-1

物性

構造計算による物性

XLogP: 0.5
極性表面積: 48 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: 3
重原子数: 17
形式電荷: 0
複雑度: 253

物理化学的性質

沸点: 400.4 · 400.4±45.0 °C(Predicted)
比重(密度): 1.14 · 1.14±0.1 g/cm3(Predicted)
酸解離定数(Pka): -1.11 · -1.11±0.20(Predicted)

安全と法規制

GHS分類

GHS Classification · 3 件

This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 2 of 2 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 2 of 2 reports by companies.；There are 0 notifications provided by 0 of 2 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 InformationStatus: Active Update: 19-01-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22072

Hazard Classes and CategoriesNot Classified

法規制情報

Regulatory InformationStatus: Active Update: 19-01-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22072

安全データ

危険有害性情報: コード危険有害性情報危険有害性クラス区分注意喚起語シンボル P コード H302

化学と産業

応用分野

使用(2R)-1-Morpholino-2-((tetrahydro-2H-pyran-2-yl)oxy)propan-1-one is useful in the synthesis of (2R,3R)-2-(2,4-difluorophenyl)-3-mercapto-1-(1H-1,2,4-triazol-1-yl)-2-butanol, an antifungal agent.