CAS 769-42-6 MFCD00006675-1,3-Dimethylbarbituric acid 1,3-二甲基巴比妥酸 TAO{mole}

SMILES: CN1C(=O)CC(=O)N(C)C1=O

Chemical Name	1,3-Dimethylbarbituric acid
CAS Number	769-42-6
Alfabeta Name	DIMETHYLBARBITURICACID 13-,
MDL Number	MFCD00006675
EC Number	212-211-7
Beilstein Registry Number	139810
Synonym	1 1,3-DIMETHYLBARBITURIC ACID 1,3-Dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione 1,3-Dimethylbarbituric acid, 99%, ca. 6% water 1,3-Dimethylhexahydropyrimidine-2,4,6-trione 1,3-Dimethylpyrimidine-2,4,6(1H,2H,5H)-trione 1,3-dimethyl-4,6(1h,3h,5h)-pyrimidinetrione 1,3-二甲基-2,4,6(1H,3H,5H)-嘧啶三酮 1,3-二甲基巴比妥酸 1,3-二甲基巴比妥酸, 99% (DRY WT.) WATER < 6% 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-dimethyl- 3-二甲基巴比妥酸 AKOS B029702 Barbituric acid, 1,3-dimethyl- Hexahydro-1,3-dimethylpyrimidine-2,4,6-trione
PubChem Substance ID	69860
Reaxys-RN	139810
Chemical Name Translation	1,3-二甲基巴比妥酸
InChIKey	VVSASNKOFCZVES-UHFFFAOYSA-N
LabNetwork Molecule ID	LN00173717
InChI	InChI=1S/C6H8N2O3/c1-7-4(9)3-5(10)8(2)6(7)11/h3H2,1-2H3

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Usually used in the following studies: Enantioselective synthesis of isochromene pyrimidinedione derivatives having five stereocenters, via one-pot Michael-Knoevenagel condensation-inverse-electron-demand hetero-Diels-Alder reaction;Synthesis of 5-aryl-6-(alkyl- or aryl-amino)-1,3-dimethylfuro [2,3-d]pyrimidine derivatives; Microwave promoted indirect functionalization of alcohols, via spirocyclisation employing a sequential one-pot Ir(III)/Pd(0) catalyzed process.

Warnings IRRITANT

Signal word Danger

GHS Symbol

WGK Germany3

Safety Statements

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；
S36/37/39 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；
S36/39 Wear suitable protective clothing and eye/face protection 穿戴适当的防护服和眼睛/面保护；

Risk Statements

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。
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。
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+P330
P305+P351+P338
P501 Dispose of contents/container to..… 处理内容物/容器.....

Hazard statements

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

Hazard Codes Xn

Sigma Aldrich:769-42-6(sigmaaldrich)
下游产品:1,3-二甲基-6-(2-羟乙基)氨基脲嘧啶
Alfa Aesar:<6% 1,3-Dimethylbarbituric acid, 99% (dry wt.), water <6%(769-42-6)" href="http://www.alfa.com/zh/GP100w.pgm?DSSTK=A13692&CAS;=769-42-6">1,3-二甲基巴比妥酸,99%(drywt.)water<6% 1,3-Dimethylbarbituric acid, 99% (dry wt.), water <6%(769-42-6)
检测方法:GC
图谱信息:1,3-二甲基巴比妥酸(769-42-6)质谱(MS) 1,3-二甲基巴比妥酸(769-42-6)核磁图( 1 HNMR) 1,3-二甲基巴比妥酸(769-42-6)红外图谱(IR1) 1,3-二甲基巴比妥酸(769-42-6)红外图谱(IR2) 1,3-二甲基巴比妥酸(769-42-6)核磁图( 13 CNMR)
MOL 文件:769-42-6.mol
水中溶解度:60 g/L (20°C)，溶于醇和丙酮。
TCI Shanghai:1，3-二甲基巴比妥酸 1,3-Dimethylbarbituric Acid,>;98.0%(GC)(T)(769-42-6)
Acros Organics:1，3-二甲基巴比妥酸 1,3-Dimethylbarbituric acid, 98%(769-42-6)
1,3-二甲基巴比妥酸价格(试剂级):更新日期产品编号产品名称包装价格 2011/08/23 K3956501 1.3-二甲基巴比妥酸 50g 385元 2011/04/16 D1618 1,3-二甲基巴比妥酸 1,3-Dimethylbarbituric Acid 25G 248元 2011/04/16 D1618 1,3-二甲基巴比妥酸 1,3-Dimethylbarbituric Acid 500G 2160元