말로닐우레아

말로닐우레아
말로닐우레아 구조식 이미지
카스 번호:
67-52-7
한글명:
말로닐우레아
동의어(한글):
말로닐우레아;바르비투르산
상품명:
Barbituric acid
동의어(영문):
pyrimidine-2,4,6(1H,3H,5H)-trione;2,4,6(1H,3H,5H)-PYRIMIDINETRIONE;barbituric;MALONYLUREA;PyriMidine-2,4,6-triol;Fluorouracil EP Impurity A;BARBITURIC ACID, FOR THE DETERMINATION O F CYANIDE;Barbitursure;ARBIBTONE ACID;Babituric acid
CBNumber:
CB0258599
분자식:
C4H4N2O3
포뮬러 무게:
128.09
MOL 파일:
67-52-7.mol
MSDS 파일:
SDS

말로닐우레아 속성

녹는점
248-252 °C (dec.) (lit.)
끓는 점
260℃ (decomposition)
밀도
1.6006 (rough estimate)
굴절률
1.4610 (estimate)
인화점
150 °C
저장 조건
Store below +30°C.
용해도
11.45g/L
물리적 상태
분말/고체
산도 계수 (pKa)
4.01(at 25℃)
색상
가벼운 크림
냄새
냄새 없는
수소이온지수(pH)
2-3 (50g/l, H2O, 60℃)
수용성
142g/L(20℃)
Merck
14,963
BRN
120502
InChIKey
HNYOPLTXPVRDBG-UHFFFAOYSA-N
CAS 데이터베이스
67-52-7(CAS DataBase Reference)
NIST
Barbituric acid(67-52-7)
EPA
Barbituric acid (67-52-7)
안전
  • 위험 및 안전 성명
  • 위험 및 사전주의 사항 (GHS)
위험 카페고리 넘버 36/37/38
안전지침서 24/25
WGK 독일 1
RTECS 번호 CP8000000
TSCA Yes
HS 번호 29335200
독성 LD50 orally in Rabbit: > 5000 mg/kg
기존화학 물질 KE-34294
97-3-1
그림문자(GHS): GHS hazard pictograms
신호 어: Warning
유해·위험 문구:
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드
H315 피부에 자극을 일으킴 피부부식성 또는 자극성물질 구분 2 경고 GHS hazard pictograms P264, P280, P302+P352, P321,P332+P313, P362
H319 눈에 심한 자극을 일으킴 심한 눈 손상 또는 자극성 물질 구분 2A 경고 GHS hazard pictograms P264, P280, P305+P351+P338,P337+P313P
H335 호흡 자극성을 일으킬 수 있음 특정 표적장기 독성 - 1회 노출;호흡기계 자극 구분 3 경고 GHS hazard pictograms
예방조치문구:
P261 분진·흄·가스·미스트·증기·...·스프레이의 흡입을 피하시오.
P304+P340 흡입하면 신선한 공기가 있는 곳으로 옮기고 호흡하기 쉬운 자세로 안정을 취하시오.
P305+P351+P338 눈에 묻으면 몇 분간 물로 조심해서 씻으시오. 가능하면 콘택트렌즈를 제거하시오. 계속 씻으시오.
P405 밀봉하여 저장하시오.
NFPA 704
1
2 1

말로닐우레아 MSDS


Malonylurea

말로닐우레아 C화학적 특성, 용도, 생산

화학적 성질

cream coloured fine crystalline powder. Odorless. Soluble in water and ether, insoluble in water and alcohol.

정의

ChEBI: Barbituric acid is a barbiturate, the structure of which is that of perhydropyrimidine substituted at C-2, -4 and -6 by oxo groups. Barbituric acid is the parent compound of barbiturate drugs, although it is not itself pharmacologically active. It has a role as an allergen and a xenobiotic. It is a conjugate acid of a barbiturate, a barbiturate(2-) and a barbiturate(1-).

제조 방법

Barbituric acid is derived By the reaction of diethyl malonate and urea. First put Urea in a reaction tank containing methanol ,heat , reflux , dissolve, then add the dried diethyl malonate and sodium methoxide, the reaction is refluxed at 66-68°C for 4-5h, after distillation to recover methanol, cooling to 40-50°C, add dilute hydrochloric acid to adjust to pH 1-2.Cool to room temperature, throw to obtain crude, wash with distilled water once, dry to get crude , and then purify with water and activated carbon, dry to obtain products. Industrial barbituric acid is white or pink crystalline powder, strongly acidic, more than 98% content, melting point ≥245°C. Material consumption fixed: diethyl malonate 1098kg/t, urea 476kg/t, hydrochloric acid (reagent grade III) 681kg/t, sodium methanol (28%) 369kg/t, methanol 1025kg/t.

화학 반응

Barbituric acid with aromatic aldehydes was used in an experimental study, meant to demonstrate the increased efficiency of Knoevenagel condensation reaction for barbituric acid and various aromatic aldehydes on basic alumina, in the absence of organic solvents under microwave irradiation. It may also be used in electrochemical oxidation of iodine, using cyclic voltammetry and controlled-potential coulometry.

일반 설명

Barbituric acid is a useful acid for organic and drug syntheses. Its dihydrate form can be synthesized from barbituric acid via crystallization from aqueous solution. Crystal structure of barbituric acid (in tautomeric form) has been investigated by a three dimensional fourier transform method. Its enol crystal form has been reported to be thermodynamically stable.

Purification Methods

Recrystallise it twice from H2O, then dry it for 2 days at 100o. [Beilstein 24 III/IV 1873.]

말로닐우레아 준비 용품 및 원자재

원자재

준비 용품


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