HCID19792002

Morpholine-3-carboxamide

C5H10N2O2130.15 g/molCAS 848488-74-4

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IDENTITY

结构与身份

标准SMILES: NC(=O)C1COCCN1
InChIKey: YPSPPJRTCRMQGD-UHFFFAOYSA-N
分子式: C5H10N2O2
平均分子量: 130.15 g/mol
单同位素质量: 130.07422757

COMPUTED

结构计算性质

已同步

XLogP: -1.6
极性表面积: 64.4 Å²
氢键供体: 2
氢键受体: 3
可旋转键: 1
重原子: 9
形式电荷: 0
复杂度: 116

GHS

GHS分类

来源：PubChem

GHS Classification

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger 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+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

HAZARDS

危害信息

来源：PubChem

Hazard Classes and Categories

Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

ALIASES

名称与别名

共 20 条

morpholine-3-carboxamide848488-74-4RefChem:819507841-865-1Morpholine-3-carboxylic acid amide3-MorpholinecarboxamideMFCD12406987SCHEMBL1317533SCHEMBL2439644SCHEMBL3563676YPSPPJRTCRMQGD-UHFFFAOYSA-NYIB48874AKOS006340095CCG-211498SB39000AS-48062DA-17434CS-0225595EN300-124383F17613

REACTIONS

参与反应

9 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09340538B2

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uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09340538B2

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uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09340538B2

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uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09340538B2

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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uspto-grants-2013_05 · 10.6084/m9.figshare.5104873.v1 · US08436011B2

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