基本情報
- CAS
13670-31-0- 標準SMILES
CC(CO)C1=NCCO1- InChIKey
SWYMJLYPXAXHBJ-UHFFFAOYSA-N- 分子式
- C6H11NO2
- 平均分子量
- 129.16 g/mol
- 単同位体質量
- 129.07897859
名称と識別子
- 優先名称
- 2-Oxazoleethanol, 4,5-dihydro-beta-methyl-
- IUPAC
- 2-(4,5-dihydro-1,3-oxazol-2-yl)propan-1-ol
- 現地名
- 4,5-ジヒドロ-β-メチル-2-オキサゾールエタノール
- 英語名
- 2-(1-(HYDROXYMETHYL)ETHYL)-OXAZOLINE&
- 分子式
- C6H11NO2
- 分子量
- 129.16
名称と別名
13670-31-02-Oxazoleethanol, 4,5-dihydro-beta-methyl-2-Oxazoleethanol, 4,5-dihydro-.beta.-methyl-DTXSID808846282-(1-(Hydroxymethyl)ethyl)-4,5-dihydrooxazole2-[1-(Hydroxymethyl)ethyl]-4,5-dihydrooxazoleRefChem:477426DTXCID901024058627-824-92-(4,5-dihydro-1,3-oxazol-2-yl)propan-1-ol2-(4,5-Dihydrooxazol-2-yl)propan-1-olSCHEMBL1126027
名称をさらに表示
4,5-ジヒドロ-β-メチル-2-オキサゾールエタノール4,5-Dihydro-β-methyl-2-oxazoleethanol2-Oxazoleethanol, 4,5-dihydro-β-methyl-2-(1-(HYDROXYMETHYL)ETHYL)-OXAZOLINE, TECH GRADE
SCHEMBL11260292-(3-hydroxy-2-propyl)-2-oxazoline2-(alpha-hydroxymethylethyl)-2-oxazoline
データベース識別子
- CAS
13670-31-0- PubChem CID
- 114555
- DTXSID
DTXSID80884628- EC Number
- 627-824-9
- Nikkaji
- J421.892B
物性
構造計算による物性
- XLogP
- -0.4
- 極性表面積
- 41.8 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
- 9
- 形式電荷
- 0
- 複雑度
- 122
物理化学的性質
- 比重(密度)
- 1.124 g/mL · 1.1240 g/mL at 25 °C(lit.)
- 屈折率
- 20 · n20/D 1.4800(lit.)
- 闪点
- 190 °F · 190 °F
- EPAの化学物質情報
- 2 · 2-Oxazoleethanol, 4,5-dihydro-.beta.-methyl- (13670-31-0)
安全と法規制
GHS分類
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.；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 CategoriesEye Irrit. 2 (100%)
安全データ
- wgk
- 3
- tsca
- TSCA listed
- risk_code
- 36
- hazard_code
- Xi
- safety_code
- 26
化学と産業
用途と製造
General Manufacturing Information2-Oxazoleethanol, 4,5-dihydro-.beta.-methyl-: INACTIVE
サプライヤー4 社
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
重庆卡兰医药有限公司[email protected]
宝鸡缔都医药化工有限公司029-029-81148929 17792602132 · [email protected]
関連反応
2 件
化合物ノート
読み込み中…