4760-53-6 (4-氨基-2-氯二苯基乙腈,(4-Amino-2-chlorophenyl)(phenyl)acetonitrile)

快速询单

结构式：

4-氨基-2-氯二苯基乙腈MOL文件

CAS号：

4760-53-6

中文名称：

4-氨基-2-氯二苯基乙腈

英文名称：

(4-Amino-2-chlorophenyl)(phenyl)acetonitrile

分子式：

C₁₄H₁₁ClN₂

分子量：

242.703541994095

4-氨基-2-氯二苯基乙腈(4760-53-6)名称与标识符

名称

中文别名：

4-氨基-2-氯二苯基乙腈;4-氨基-2-氯化乙腈;(4-氨基-2-氯苯基)(苯基)乙腈;(4-氨基-2-氯苯基)苯乙腈;2-(4-氨基-2-氯-苯基)-2-苯基-乙腈;2-(4-氨基-2-氯-苯基)-2-苯基-乙烷腈;2-(4-氨基-2-氯苯基)-2-苯乙腈;

英文别名：

4-amino,2-chlorodiphenylacetonitrile;(4-amino-2-chlorophenyl)phenyl-acetonitril;4-amino-2-chloro-alpha-phenyl-benzeneacetonitril;4-amino-2-chloro-alpha-phenylbenzeneacetonitrile;4-AMINO-2-CHLORODIPHENYLACETONITRILE;TIMTEC-BB SBB000827;(4-amino-2-chlorophenyl)phenylacetonitrile;(4-Amino-2-chlorophenyl)(phenyl)acetonitrile;2-(4-amino-2-chlorophenyl)-2-phenylacetonitrile;EINECS 225-298-1;SY083600;AKOS000120682;AS-76255;SB80903;Benzeneacetonitrile, 4-amino-2-chloro-alpha-phenyl-;AKOS016347228;MFCD00066975;Z104486042;NS00045079;4760-53-6;CS-0452829;EN300-21003;Benzeneacetonitrile, 4-amino-2-chloro-.alpha.-phenyl-;SCHEMBL6806976;4-amino-2-chlorodiphenylacetonitrile, AldrichCPR;ISOPQUKKXCXJIJ-UHFFFAOYSA-N;D95178;DTXSID60963884;

标识符

MDL：

MFCD00066975

InChIKey：

ISOPQUKKXCXJIJ-UHFFFAOYSA-N

Inchi：

1S/C14H11ClN2/c15-14-8-11(17)6-7-12(14)13(9-16)10-4-2-1-3-5-10/h1-8,13H,17H2

SMILES：

ClC1C=C(C=CC=1C(C#N)C1C=CC=CC=1)N

4-氨基-2-氯二苯基乙腈(4760-53-6)物化性质

实验特性

LogP : 4.15888
PSA : 49.81000
折射率 : 1.5749 (estimate)
沸点 : 385.71°C (rough estimate)
熔点 : 79-87 °C
蒸气压 : 0.0±1.0 mmHg at 25°C
闪点 : 203.8°C
颜色与性状 : 棕色结晶性粉末
溶解性 : 未确定
密度 : 1.1848 (rough estimate)

计算特性

精确分子量 : 242.06100
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 : 242.061076
重原子数量 : 17
复杂度 : 290
同位素原子数量 : 0
确定原子立构中心数量 : 1
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） : 3.2
表面电荷 : 0
拓扑分子极性表面积 : 49.8

4-氨基-2-氯二苯基乙腈(4760-53-6)安全信息

安全说明： 36/37
风险术语： R20/21/22
危险品标志： Xn
危害声明：H303吞入可能有害+H313皮肤接触可能有害+H333吸入可能对身体有害
警示性声明：P264+P280+P305+P351+P338+P337+P313
储存条件： storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
危险类别码： 20/21/22-22
信号词： warning
HazardClass： IRRITANT

4-氨基-2-氯二苯基乙腈(4760-53-6)海关数据

海关编码：

2926909090

海关数据：

中国海关编码：

2926909090

概述：

2926909090 其他腈基化合物. 增值税率:17.0% 退税率:9.0% 监管条件:无最惠国关税:6.5% 普通关税:30.0%

申报要素：

品名, 成分含量, 用途

Summary：

HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

4-氨基-2-氯二苯基乙腈(4760-53-6)推荐厂家更多厂家(8)

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江苏从众化工股份有限公司	18662433356	胡		询单

4-氨基-2-氯二苯基乙腈(4760-53-6)参考资料

Reaxys RN：

PubChem CID：

107335

4-氨基-2-氯二苯基乙腈(4760-53-6) MSDS

基础信息

Name:	4-Amino-2-chlorodiphenylacetonitrile Material Safety Data Sheet
Synonym:	None.
CAS:	4760-53-6

Section 1 - Chemical Product MSDS Name: 4-Amino-2-chlorodiphenylacetonitrile Material Safety Data Sheet
Synonym: None.

SECTION 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
4760-53-6	4-Amino-2-chlorodiphenylacetonitrile	>98 %	225-298-1

Hazard Symbols: XN
Risk Phrases: 20/21/22

SECTION 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW Harmful by inhalation, in contact with skin and if swallowed. Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. Harmful if absorbed through the skin.
Ingestion:
Harmful if swallowed. Causes gastrointestinal irritation with nausea, vomiting and diarrhea.
Inhalation:
Harmful if inhaled. Causes respiratory tract irritation.
Chronic:
No information found.

SECTION 4 - FIRST AID MEASURES
Eyes:
Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Call a poison control center. If swallowed, do not induce vomiting unless directed to do so by medical personnel. Never give anything by mouth to an unconscious person. Get medical aid.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

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.
Extinguishing Media:
Use foam, dry chemical, or carbon dioxide.

SECTION 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container. Clean up spills immediately, observing precautions in the Protective Equipment section.

SECTION 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Wash hands before eating. Remove contaminated clothing and wash before reuse. Use only in a well-ventilated area. Do not get on skin or in eyes. Do not ingest or inhale.
Storage:
Store in a cool, dry place. Store in a tightly closed container.

SECTION 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Use adequate general or local explosion-proof ventilation to keep airborne levels to acceptable levels. Exposure Limits CAS# 4760-53-6: 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:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

SECTION 9 - PHYSICAL AND CHEMICAL PROPERTIES
Physical State: Solid
Color: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
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: C14H11ClN2
Molecular Weight: 242.71

SECTION 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Hydrogen chloride, carbon monoxide, oxides of nitrogen, carbon dioxide.
Hazardous Polymerization: Has not been reported.

SECTION 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 4760-53-6: CY1692900
LD50/LC50:
CAS# 4760-53-6: Oral, mouse: LD50 = >500 mg/kg.
Carcinogenicity:
4-Amino-2-chlorodiphenylacetonitrile - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

SECTION 12 - ECOLOGICAL INFORMATION

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

SECTION 14 - TRANSPORT INFORMATION IATA Not regulated as a hazardous material. IMO Not regulated as a hazardous material. RID/ADR Not regulated as a hazardous material.

SECTION 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives
Hazard Symbols: XN
Risk Phrases:
R 20/21/22 Harmful by inhalation, in contact with skin and if swallowed.
Safety Phrases:
S 36/37 Wear suitable protective clothing and gloves. WGK (Water Danger/Protection) CAS# 4760-53-6: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 4760-53-6 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 4760-53-6 is not listed on the TSCA inventory. It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
MSDS Creation Date: 2/08/1999 Revision #2 Date: 12/03/2002 The information above is believed to be accurate and represents the best information currently available to us. However, we make no warranty of merchantability or any other warranty, express or implied, with respect to such information, and we assume no liability resulting from its use. Users should make their own investigations to determine the suitability of the information for their particular purposes. In no way shall the company be liable for any claims, losses, or damages of any third party or for lost profits or any special, indirect, incidental, consequential or exemplary damages, howsoever arising, even if the company has been advised of the possibility of such damages.

SECTION 16 - ADDITIONAL INFORMATION
N/A