4410-12-2 (1-苄基高哌嗪,1-Benzyl-1,4-diazepane)

快速询单

结构式：

1-苄基高哌嗪MOL文件

CAS号：

4410-12-2

中文名称：

1-苄基高哌嗪

英文名称：

1-Benzyl-1,4-diazepane

安全信息：

分子式：

C₁₂H₁₈N₂

分子量：

190.284722805023

1-苄基高哌嗪(4410-12-2)名称与标识符

名称

中文别名：

1-苄基高哌嗪;N-苄基高哌嗪;苄基高哌嗪;1-苄基-1,4-二氮杂庚烷;1-苄基-1,4-二氮杂环庚烷;1-苄基-1,4-二氮杂卓;

英文别名：

1-Benzyl-1,4-diazepane;1-Benzylhexahydro-1,4-diazepine;N-benzylhomopiperazine;1-Benzyl(hexahydro)-1,4-diazepine;1-BENZYL-1,4-DIAZACYCLOHEPTANE;1-Benzylhomopiperazine;1H-1,4-Diazepine, hexahydro-1-(phenylmethyl)-;1-benzyl-1,4-diazaperhydroepine;benzyihomopiperazine;NSC21234;benzyl homopiperazine;1-benzyihomopiperazine;PubChem14547;Peakdale1_000795;1-Benzyl-[1,4]diazepane;KSC497S4N;1-Benzyl-[1,4]-diazepane;HMS520E03;1-Benzylhexahy;A12528;JTJTYCPQUOROFM-UHFFFAOYSA-N;NSC-21234;DTXSID70281304;MFCD00800858;4410-12-2;AB01166004-03;A6801;NSC-179501;W-204283;NCGC00328853-01;N-Benzylhomopiperazine, 97%;Z169852140;NSC179501;AMY6948;SCHEMBL255099;EN300-24147;CS-W015875;FS-1467;J-504246;AKOS000264468;FT-0635276;STK500862;N-Benzylhomopiperazine;1-Benzyl-1,4diazepane;

标识符

MDL：

MFCD00800858

InChIKey：

JTJTYCPQUOROFM-UHFFFAOYSA-N

Inchi：

1S/C12H18N2/c1-2-5-12(6-3-1)11-14-9-4-7-13-8-10-14/h1-3,5-6,13H,4,7-11H2

SMILES：

N1(CC2C=CC=CC=2)CCNCCC1

BRN：

147009

1-苄基高哌嗪(4410-12-2)物化性质

实验特性

LogP : 1.74860
PSA : 15.27000
折射率 : n20/D 1.547
沸点 : 93 °C
蒸气压 : 0.0±0.6 mmHg at 25°C
闪点 : 华氏：>230 °F
摄氏：>110 °C
颜色与性状 : 无色液体
溶解性 : 不确定
敏感性 : Air Sensitive
密度 : 1.028 g/mL at 25 °C

计算特性

精确分子量 : 190.14700
氢键供体数量 : 1
氢键受体数量 : 2
可旋转化学键数量 : 2
同位素质量 : 190.147
重原子数量 : 14
复杂度 : 152
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 1.5
表面电荷 : 0
拓扑分子极性表面积 : 15.3

1-苄基高哌嗪(4410-12-2)安全信息

符号： GHS07
WGK Germany： 2
安全术语： 8
安全说明： S26-S36
包装等级： III
包装类别： III
风险术语： R34
危险等级： 8
危险品标志： Xn Xi C
危险品运输编号： 2735
危害声明：H302-H315-H319-H335
警示性声明：P261-P305 + P351 + P338
储存条件： storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
PackingGroup： III
危险类别码： 22-36/37/38
信号词： Warning
HazardClass： 8

1-苄基高哌嗪(4410-12-2)国际标准相关数据

EINECS：

24884306

1-苄基高哌嗪(4410-12-2)海关数据

海关编码：

2933990090

海关数据：

中国海关编码：

2933990090

概述：

2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素：

品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期

Summary：

2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1-苄基高哌嗪(4410-12-2)推荐厂家更多厂家(29)

公司名称	手机号/电话	联系人	QQ	询单
山东玖玥生物科技有限公司	15553333686	张文杰	643971	询单
湖北达豪化工有限公司	13986246535	刘紫莹	1400878822	询单
湖北拓邦化工有限公司	15102763473 027-59106185	涂梦婷	1400868822/1248089955	询单
上海瀚思化工有限公司	18939883912 021-34536277	顾经理	3003949364	询单
湖北成海化工有限公司	13986212397 027-59220433	张思胧	1400858822	询单
铼博（上海）生化科技有限公司	13311756052 021-60536361 13311756052 13311756131	张经理	2851717387	询单
湖北诺纳科技有限公司	17386169806 027-59209883	张经理	1141855188	询单
上海一基实业有限公司	13311756131 021-60548336 QQ：2355265332 QQ:2851717387	胡经理	2355265332	询单
武汉鑫伟烨化工有限公司	18502781673 18502781673	张经理	359501377	询单
上海腾准生物科技有限公司	19821570922 021-34053661	张经理	3003871136	询单

1-苄基高哌嗪(4410-12-2)参考资料

Reaxys RN：

Beilstein：

MFCD00800858

PubChem CID：

228365

1-苄基高哌嗪(4410-12-2) MSDS

基础信息

Name:	1-Benzyl-1 4-diazepane Material Safety Data Sheet
Synonym:	None Known
CAS:	4410-12-2

Section 1 - Chemical Product ? MSDS Name:1-Benzyl-1 4-diazepane Material Safety Data Sheet
Synonym:None Known

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
4410-12-2	1-Benzyl-1,4-diazepane	90+	unlisted

Hazard Symbols: C
Risk Phrases: 35

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Causes severe burns.
Potential Health Effects
Eye:
Causes severe eye burns.
Skin:
Causes severe burns.
Ingestion:
Causes severe digestive tract burns.
Inhalation:
Causes chemical burns to the respiratory tract.
Chronic:
Chronic exposure may cause effects similar to those of acute exposure.

Section 4 - FIRST AID MEASURES
? Eyes: Get medical aid immediately. Do NOT allow victim to rub eyes or keep eyes closed. Extensive irrigation with water is required (at least 30 minutes).
Skin:
In case of contact, immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Get medical aid immediately. Wash clothing before reuse.
Ingestion:
If swallowed, do NOT induce vomiting. Get medical aid immediately.
If victim is fully conscious, give a cupful of water. Never give anything by mouth to an unconscious person.
Inhalation:
Get medical aid immediately. Remove from exposure and move to fresh air immediately. If breathing is difficult, give oxygen. Do NOT use mouth-to-mouth resuscitation.
Notes to Physician:
Treat symptomatically and supportively.

Section 5 - FIRE FIGHTING MEASURES
? General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or appropriate foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
? General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container. Avoid runoff into storm sewers and ditches which lead to waterways. Clean up spills immediately, observing precautions in the Protective Equipment section. Provide ventilation.

Section 7 - HANDLING and STORAGE
? Handling:
Wash thoroughly after handling. Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Keep container tightly closed. Do not ingest or inhale. Discard contaminated shoes.
Use only with adequate ventilation.
Storage:
Store in a tightly closed container. Corrosives area. Store under an inert atmosphere.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
? Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 4410-12-2: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Liquid
Color: colorless
Odor: slight
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 93-96 deg C @ 0.2mmHg
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C12H18N2
Molecular Weight: 190.3

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
None reported.
Incompatibilities with Other Materials:
Oxidizing agents, acids, acid chlorides.
Hazardous Decomposition Products:
Carbon monoxide, oxides of nitrogen, carbon dioxide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 4410-12-2 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1-Benzyl-1,4-diazepane - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION
? Ecotoxicity:
Fish: Pseudomonas putida:

Section 13 - DISPOSAL CONSIDERATIONS
? Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
?
IATA
Shipping Name: AMINES, LIQUID, CORROSIVE, N.O.S.
Hazard Class: 8
UN Number: 2735
Packing Group: II
IMO
Shipping Name: AMINES, LIQUID, CORROSIVE, N.O.S.
Hazard Class: 8
UN Number: 2735
Packing Group: II
RID/ADR
Shipping Name: AMINES, LIQUID, CORROSIVE, N.O.S.
Hazard Class: 8
UN Number: 2735
Packing group: II

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: C
Risk Phrases:
R 35 Causes severe burns.
Safety Phrases:
S 6 Keep under nitrogen.
S 23 Do not inhale gas/fumes/vapour/spray.
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 4410-12-2: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 4410-12-2 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 4410-12-2 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A