CAS 652-37-9 MFCD00022832-Acefylline 茶碱乙酸 TAO{mole}

Acefylline 茶碱乙酸

CAS 652-37-9 MFCD00022832

化学结构图

SMILES: Cn1c(=O)c2c(ncn2CC(=O)O)n(C)c1=O

化学属性

Mol. Formula	C9H10N4O4
Mol. Weight	238.20
Melting Point	270-272 °C
TSCA	No
Density	1.651
Boiling Point	555.7 °C at 760 mmHg

别名和识别编码

Chemical Name	Theophylline-7-acetic Acid
CAS Number	652-37-9
Synonym	Acefylline {LY} Acefylline acefylline acefylline, sodium salt acephylline theophylline-7-acetic acid {} {LY} Acefylline {} {} {LY} Acefylline {} {} {} {LY} Acefylline {} {} {} {} {LY} Acefylline {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Acefylline {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
MDL Number	MFCD00022832
PubChem Substance ID	69550
Beilstein Registry Number	279221
EC Number	211-490-2
Merck Number	24
Alfabeta Name	DIMETHYLDIOXOTETRAHYDROPURINYLACETICACID H1326123677()---------,,,,,
Chemical Name Translation	茶碱乙酸
Reaxys-RN	279221
LabNetwork Molecule ID	LN00183579
InChI	InChI=1S/C9H10N4O4/c1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h4H,3H2,1-2H3,(H,14,15)
Canonical SMILES	O=C(O)CN1C=NC(N(C)C(N2C)=O)=C1C2=O

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品牌质保精细包装现货库存一流品牌服务

产品应用

A xanthine derivative with bronchodilator activity. Typically combined as salt component with other medications such as Ambroxol to treat bronchial and pulmonary diseases.

安全信息

WGK Germany2

GHS Symbol

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。
P264+P265
P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
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。
P301+P312
P301+P312+P330
P301+P317
P302+P352
P302+P352+P332+P313+P362+P364
P304+P340
P305+P351+P338
P305+P351+P338+P337+P313
P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
P319
P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
P330 Rinse mouth. 漱口
P332+P313
P332+P317
P337+P313
P337+P317
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
P362+P364
P403+P233
P405 Store locked up. 上锁保管。
P501 Dispose of contents/container to..… 处理内容物/容器.....

Hazard statements

H302 Harmful if swallowed 吞食有害
H315 Causes skin irritation 会刺激皮肤
H319 Causes serious eye irritation 严重刺激眼睛
H335 May cause respiratory irritation 可能导致呼吸道刺激

RTECSUO7451300

Signal word Warning

Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves

Safety Statements

S36 Wear suitable protective clothing 穿戴适当的防护服；
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；
S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；

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
R22 Harmful if swallowed 吞咽有害

Hazard Codes Xi

Warnings IRRITANT

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   USXXAM United States Patent Document.  (U.S. Patent Office, Box 9,
   Washington, DC 20231)  Volume(issue)/page/year: #4035366

{haz

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 2733 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 116,343,1956

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1180 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 116,343,1956

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   USXXAM United States Patent Document.  (U.S. Patent Office, Box 9,
   Washington, DC 20231)  Volume(issue)/page/year: #4035366

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

其他信息

Sigma Aldrich:652-37-9(sigmaaldrich)
MOL 文件:652-37-9.mol
茶碱乙酸价格(试剂级):更新日期产品编号产品名称包装价格 2010/05/25 A11473 茶碱 -7-乙酸, 98% Theophylline-7-acetic acid, 98% 500g 3234元 2010/05/25 A11473 茶碱 -7-乙酸, 98% Theophylline-7-acetic acid, 98% 25g 272元 2010/05/25 A11473 茶碱 -7-乙酸, 98% Theophylline-7-acetic acid, 98% 100g 763元
Alfa Aesar:茶碱-7-乙酸,98% Theophylline-7-acetic acid, 98%(652-37-9)