CAS 1197-55-3 MFCD00007916-4-Aminophenylacetic acid 对氨基苯乙酸 -LabNovo

4-Aminophenylacetic acid 对氨基苯乙酸

CAS 1197-55-3 MFCD00007916

化学结构图

SMILES: NC1CCC(CC(=O)O)CC1

化学属性

Mol. Formula	C8H9NO2
Mol. Weight	151.16
Melting Point	201°C
Density	1.268
TSCA	Yes
Flash Point	201°C
Appearance	无色板或片状晶体。熔点为199-200℃（分解）。溶于醇、碱液，略溶于热水。
Boiling Point	344°C at 760 mmHg

别名和识别编码

Chemical Name	4-Aminophenylacetic acid
CAS Number	1197-55-3
Alfabeta Name	AMINOPHENYLACETICACID 4-
MDL Number	MFCD00007916
Synonym	4-Aminophenylacetic acid {LY} 4-Aminophenylacetic acid {} {LY} 4-Aminophenylacetic acid {} {} {LY} 4-Aminophenylacetic acid {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Aminophenylacetic acid {} {} {} {} {} {} {} {} {} {} {
EC Number	214-828-7
Beilstein Registry Number	14(3)1182
PubChem Substance ID	87562031
Merck Number	14,463
Chemical Name Translation	对氨基苯乙酸
Reaxys-RN	2208094
Wiswesser Line Notation	ZR D1VQ
LabNetwork Molecule ID	LN00122670
InChI	InChI=1S/C8H9NO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5,9H2,(H,10,11)
Canonical SMILES	O=C(O)CC1=CC=C(C=C1)N

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产品应用

可作有机合成原料和医药中间体。

安全信息

Warnings IRRITANT

Signal word Warning

GHS Symbol

WGK Germany3

Safety Statements

S22 Do not breathe dust 不要吸入粉尘；
S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
S37 Wear suitable gloves 戴适当手套；
S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；

Risk Statements

R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性

Precautionary statements

P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
P302+P350
P302+P352+P332+P313+P362+P364
P305+P351+P338
P305+P351+P338+P337+P313
P332+P313
P337+P313
P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用

RTECSAF3550000

Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Hazard statements

H315 Causes skin irritation 会刺激皮肤

Hazard Codes Xi

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 3500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia,
   Italy)  V.8-43 1953-88 For publisher information, see FRMCE8
   Volume(issue)/page/year: 13,286,1958

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NCNSA6 National Academy of Sciences, National Research Council,
   Chemical-Biological Coordination Center, Review.  (Washington, DC)
   Volume(issue)/page/year: 5,11,1953

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 2500 ug/plate
REFERENCE :
   DEMAEP Dental Materials.  (Munksgaard International Pub., POB 2148, DK-1016
   Copenhagen K, Denmark) V.1-    1985-  Volume(issue)/page/year: 2,163,1986

Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

Alfa Aesar:4-氨基苯基乙酸,98% 4-Aminophenylacetic acid, 98%(1197-55-3)
毒性分级:中毒
用途二:可作有机合成原料和医药中间体。
下游产品:N-乙基双氧哌嗪酰氨苯乙酸 --> 对羟基苯乙酸 --> 4-二甲胺基苯基乙酸 --> 对羟基苯甘氨酸 --> 苯甘氨酰氯
MOL 文件:1197-55-3.mol
对氨基苯乙酸价格(试剂级):更新日期产品编号产品名称包装价格 2014/06/02 A0393 4-氨基苯基乙酸 4-Aminophenylacetic Acid 25G 623元 2014/06/02 A0393 4-氨基苯基乙酸 4-Aminophenylacetic Acid 500G 5650元 2010/06/21 104280250 对氨基苯乙酸 4-Aminophenylacetic acid 98% 25 GR 895元
用途一:用作有机合成原料及用于制取医药中间体
图谱信息:对氨基苯乙酸(1197-55-3)核磁图( 1 HNMR) 对氨基苯乙酸(1197-55-3)质谱(MS) 对氨基苯乙酸(1197-55-3)红外图谱(IR1) 对氨基苯乙酸(1197-55-3)红外图谱(IR2)
可燃性危险特性:可燃;燃烧产生有毒氮氧化物烟雾
类别:有毒物品
溶于醇、碱液，略溶于热水。
Decomposition:201 °C
MSDS 信息:p-Aminophenylacetic acid(1197-55-3).msds
方法一:由对硝基苯乙酸还原而得。反应器加入水、对硝基苯乙酸和乙酸，搅拌并加热到90-95℃，分次加入铁粉，加毕回流2h，冷却至40-50℃，用碳酸钠中和使pH=9，过滤。滤液用乙酸中和，直至pH=4，析出对氨基苯乙酸。收率为95%。
急性毒性:腹腔-小鼠LD50: 3500 毫克/公斤
Sigma Aldrich:1197-55-3(sigmaaldrich)
F:13
储运特性:库房通风低温干燥
TCI Shanghai:4-氨基苯基乙酸 4-Aminophenylacetic Acid,>;98.0%(LC)(T)(1197-55-3)
海关编码:29224995
检测方法:HPLC,NMR
Acros Organics:4-氨基苯乙酸 4-Aminophenylacetic acid, 98%(1197-55-3)
灭火剂:干粉、泡沫、砂土、二氧化碳, 雾状水
上游原料:铁粉 --> 对硝基苯乙酸