uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07745450B2
查看IDENTITY
结构与身份
- 标准SMILES
- CCCCCCCN
- InChIKey
- WJYIASZWHGOTOU-UHFFFAOYSA-N
- 分子式
- C7H17N
- 平均分子量
- 115.22 g/mol
- 单同位素质量
- 115.13609955
COMPUTED
结构计算性质
- XLogP
- 2.6
- 极性表面积
- 26 Ų
- 氢键供体
- 1
- 氢键受体
- 1
- 可旋转键
- 5
- 重原子
- 8
- 形式电荷
- 0
- 复杂度
- 35
PROPERTIES
实验与物化性质
Ionization Efficiency
Positive
3.51
2.7
Agilent XCT
Electrospray ionization
formic acid (5.3nM)
Kovats Retention Index
930;937;941;928;943.2;939;930;931;931;942;932;933;934;935
918;930;931;932;932;932;932;932;933;933;933;933;934;934;935;931;932;933;933;934
1218;1215;1215;1217;1219;1220;1223;1213
GHS
GHS分类
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids];H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 47 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.
HAZARDS
危害信息
Regulatory Information
Chemical: 1-Heptanamine
Status: Cease Manufacture Update: 08-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21376
1-Heptanamine: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and Categories
Flam. Liq. 3 (100%);Skin Corr. 1A (100%)
REGULATORY
法规信息
Regulatory Information
Chemical: 1-Heptanamine
Status: Cease Manufacture Update: 08-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21376
1-Heptanamine: Does not have an individual approval but may be used under an appropriate group standard
USES
用途与制造
General Manufacturing Information
1-Heptanamine: ACTIVE
ALIASES
名称与别名
REACTIONS
参与反应
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