基本情報
- CAS
1078627-29-8- 標準SMILES
OC1(CC(F)(F)F)CC1- InChIKey
KRVMZDAAXUIYJP-UHFFFAOYSA-N- 分子式
- C5H7F3O
- 平均分子量
- 140.1 g/mol
- 単同位体質量
- 140.04489933
名称と識別子
- 優先名称
- 1-(2,2,2-Trifluoroethyl)cyclopropan-1-ol
- IUPAC
- 1-(2,2,2-trifluoroethyl)cyclopropan-1-ol
名称と別名
1-(2,2,2-trifluoroethyl)cyclopropan-1-ol1078627-29-8RefChem:420148887-080-81-(2,2,2-trifluoroethyl)cyclopropanol1-trifluoroethylcyclopropanolSCHEMBL3375449AKOS011963949EN300-1939380
データベース識別子
- CAS
1078627-29-8- PubChem CID
- 57445153
- EC Number
- 887-080-8
物性
構造計算による物性
- XLogP
- 1.4
- 極性表面積
- 20.2 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 4
- 回転可能結合数
- 1
- 重原子数
- 9
- 形式電荷
- 0
- 複雑度
- 114
安全と法規制
GHS分類
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, 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.
危険有害性情報
Hazard Classes and CategoriesFlam. Liq. 3 (100%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)
関連反応
3 件
化合物ノート
読み込み中…