基本情報
- CAS
1092649-16-5- 標準SMILES
C[C@@H]1CN(CCN)C[C@H](C)O1- InChIKey
GLOJLKCUVTZRFO-OCAPTIKFSA-N- 分子式
- C8H18N2O
- 平均分子量
- 158.24 g/mol
- 単同位体質量
- 158.1419132
名称と識別子
- 優先名称
- 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethan-1-amine
- IUPAC
- 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethanamine
- 英語名
- 4-(2-AMINOETHYL)-CIS-2,6-DIMETHYLMORPHOLINE
- 分子式
- C8H18N2O
- 分子量
- 158.24
名称と別名
1092649-16-52-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethan-1-amine2-((2R,6S)-2,6-dimethylmorpholin-4-yl)ethan-1-amineRefChem:447896830-991-24-(2-Aminoethyl)-cis-2,6-dimethylmorpholine2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethanaminecis-2,6-dimethylaminoethylmorpholine2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethanamineMFCD06239282SCHEMBL2151256SCHEMBL2443514
名称をさらに表示
4-Morpholineethanamine, 2,6-dimethyl-,(2R,6S)-rel-
GLOJLKCUVTZRFO-OCAPTIKFSA-NUJA78918AKOS006344017FS-4916EN300-1236556F019579Rel-2-((2R,6S)-2,6-dimethylmorpholino)ethan-1-amine4-(2-Aminoethyl)-cis-2,6-dimethylmorpholine, AldrichCPR
データベース識別子
- CAS
1092649-16-5- PubChem CID
- 7144968
- EC Number
- 830-991-2
物性
構造計算による物性
- XLogP
- -0.2
- 極性表面積
- 38.5 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 3
- 回転可能結合数
- 2
- 重原子数
- 11
- 形式電荷
- 0
- 複雑度
- 109
物理化学的性質
- 沸点
- 224.6 · 224.6±20.0 °C(Predicted)
- 比重(密度)
- 0.931 · 0.931±0.06 g/cm3(Predicted)
- 酸解離定数(Pka)
- 9.98 · 9.98±0.10(Predicted)
安全と法規制
GHS分類
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 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 Corr. 1B (100%)；STOT SE 3 (100%)
安全データ
- risk_code
- 22-36
- hazard_code
- Xn
- safety_code
- 26
化学と産業
サプライヤー5 社
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海馨远医药科技有限公司021-24206007 13764915196 · [email protected]
苏州启航生物科技有限公司18662190603 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
関連反応
4 件
化合物ノート
読み込み中…