Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
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IDENTITY
结构与身份
- 标准SMILES
- CCCCCCCCCCI
- InChIKey
- SKIDNYUZJPMKFC-UHFFFAOYSA-N
- 分子式
- C10H21I
- 平均分子量
- 268.18 g/mol
- 单同位素质量
- 268.0688
COMPUTED
结构计算性质
- XLogP
- 6.3
- 极性表面积
- 0 Ų
- 氢键供体
- 0
- 氢键受体
- 0
- 可旋转键
- 8
- 重原子
- 11
- 形式电荷
- 0
- 复杂度
- 61
PROPERTIES
实验与物化性质
Vapor Pressure
0.01 [mmHg]
Physical Description
Colorless or yellow liquid; [Alfa Aesar MSDS]
Kovats Retention Index
1433
1433
1705；1706；1734
GHS
GHS分类
GHS Classification
Warning
H315 (97.9%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (87.2%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H413 (80.9%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 47 reports by companies from 7 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.
HAZARDS
危害信息
Hazards Summary
Intraperitoneal LD50 (mouse) = 4,550 mg/kg; [RTECS] A skin and strong eye irritant; [Alfa Aesar MSDS]
Hazard Classes and Categories
Skin Irrit. 2 (97.9%)；Eye Irrit. 2 (100%)；STOT SE 3 (87.2%)；Aquatic Chronic 4 (80.9%)
USES
用途与制造
General Manufacturing Information
Decane, 1-iodo-: ACTIVE
ALIASES
名称与别名
1-IODODECANEDecane, 1-iodo-Decyl iodiden-Decyl iodide1-Decyl iodideEINECS 218-104-11-Iod0decaneDTXSID9062142Decane, 1iodoRefChem:76095DTXCID2036322218-104-1SKIDNYUZJPMKFC-UHFFFAOYSA-N2050-77-31-iodo-decaneMFCD00001085C10H21I1-Decyl Iodide; Decyl Iodide; n-Decyl Iodide;iododecane1-LODODECANE
REACTIONS
相关反应
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