反应SMILES:CCCCCCCCCCI
HCID16314

1-Iododecane

C10H21I268.18 g/molCAS 2050-77-3

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

已同步
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

来源:PubChem
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

来源:PubChem
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

来源:PubChem
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

来源:PubChem
General Manufacturing Information

Decane, 1-iodo-: ACTIVE

ALIASES

名称与别名

共 40 条
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

参与反应

36
HRID100267

Training data from https://doi.org/10.1039/C8SC04228D (2/10)

作为反应物
HRID 100267 方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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HRID109286

Training data from https://doi.org/10.1039/C8SC04228D (2/10)

作为反应物
HRID 109286 方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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HRID114674

Training data from https://doi.org/10.1039/C8SC04228D (2/10)

作为反应物
HRID 114674 方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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HRID175733

Training data from https://doi.org/10.1039/C8SC04228D (6/10)

作为反应物
HRID 175733 方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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HRID188051

Training data from https://doi.org/10.1039/C8SC04228D (6/10)

作为反应物
HRID 188051 方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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HRID223771

uspto-grants-1982_10

作为反应物
HRID 223771 方程式

uspto-grants-1982_10 · 10.6084/m9.figshare.5104873.v1 · US04356309

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HRID249064

uspto-grants-1993_05

作为反应物
HRID 249064 方程式

uspto-grants-1993_05 · 10.6084/m9.figshare.5104873.v1 · US05212303

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HRID256784

uspto-grants-1993_11

作为反应物
HRID 256784 方程式

uspto-grants-1993_11 · 10.6084/m9.figshare.5104873.v1 · USRE034440

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