基本情報
- CAS
6628-83-7- 標準SMILES
NCC1CCCCO1- InChIKey
NYGCBQKDTGBHSC-UHFFFAOYSA-N- 分子式
- C6H13NO
- 平均分子量
- 115.17 g/mol
- 単同位体質量
- 115.09971404
名称と識別子
- 優先名称
- (Tetrahydro-2H-pyran-2-ylmethyl)amine
- IUPAC
- oxan-2-ylmethanamine
- 現地名
- 2-(アミノメチル)テトラヒドロ-2H-ピラン
- 英語名
- C-(TETRAHYDRO-PYRAN-2-YL)-METHYLAMINE HYDROCHLORIDE
- 分子式
- C6H13NO
- 分子量
- 115.17
名称と別名
(Tetrahydro-2H-pyran-2-ylmethyl)amineRefChem:408472804-850-06628-83-72-(Aminomethyl)tetrahydropyranoxan-2-ylmethanamine(tetrahydro-2H-pyran-2-yl)methanamineTetrahydropyran-2-ylmethylamineC-(Tetrahydro-pyran-2-yl)-methylamine2-(Aminomethyl)tetrahydro-2H-pyran2-Aminomethyltetrahydropyran2H-Pyran-2-methanamine, tetrahydro-
名称をさらに表示
2-(アミノメチル)テトラヒドロ-2H-ピラン(テトラヒドロ-2H-ピラン-2-イルメチル)アミン1-(オキサン-2-イル)メタンアミンテトラヒドロピラン-2-イルメチルアミンN-Methyloxan-2-aMine2-aminomethyltetrahydro-pyra2-tetrahydropyranylmethanaminetetrahydropyran-2-ylmethanamine
(oxan-2-yl)methanaminePyran, 2-(aminomethyl)tetrahydro-MFCD00129175Pyran, 2-aminomethyltetrahydro-2H-Pyran-2-methylamine, tetrahydro-NSC 597241-(tetrahydro-2H-pyran-2-yl)methanamine hydrochloride2H-3,4,5,6-tetrahydropyran-2-ylmethylamine
データベース識別子
- CAS
6628-83-7- PubChem CID
- 97924
- DTXSID
DTXSID901031748- EC Number
- 804-850-0
- Nikkaji
- J51.176E
物性
構造計算による物性
- XLogP
- 0
- 極性表面積
- 35.3 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 2
- 回転可能結合数
- 1
- 重原子数
- 8
- 形式電荷
- 0
- 複雑度
- 65
物理化学的性質
- 沸点
- 211.9 °C · 211.9°C (rough estimate)
- 比重(密度)
- 1.0223 · 1.0223 (rough estimate)
- 屈折率
- 1.421 · 1.4210 (estimate)
- 外見
- liquid
- 色
- light brown
- InChI
- 1S/C6H13NO/c7-5-6-3-1-2-4-8-6/h6H,1-5,7H2
- InChIKey
- NYGCBQKDTGBHSC-UHFFFAOYSA-N
- SMILES
- NCC1CCCCO1
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Danger
H302 (90%): Harmful if swallowed [Warning Acute toxicity, oral]；H314 (30%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (10%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (10%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (30%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 10 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 CategoriesAcute Tox. 4 (90%)；Skin Corr. 1B (30%)；STOT SE 3 (30%)
安全データ
- wgk
- WGK 3
- hs_code
- 2932990090
- risk_code
- 41
- safety_code
- 26-39
- hazard_class
- IRRITANT
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1
- ストレージクラス
- 11 - Combustible Solids
化学と産業
サプライヤー56 社
宁波振岳医药科技有限公司19817745290 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海骏腾医药科技有限公司15900602605 15900602605 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
Wuhan Konberd Biotech Co., Ltd+undefined-18986093962 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Shangchem Co., Ltd.+86-21-68182121
上海相辉医药科技有限公司
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