1,3-Dimethyl-1,3-diphenylurea

1,3-Dimethyl-1,3-diphenylurea 구조식 이미지
카스 번호:
611-92-7
상품명:
1,3-Dimethyl-1,3-diphenylurea
동의어(영문):
Centralite II;Zentralin;Zentralit I;Centralite-2;Centralit II;Zentralit II;Centralite ll;METHYL CENTRALITE;Dimethyldiphenylurea;sym-Dimethyldiphenylurea
CBNumber:
CB9218833
분자식:
C15H16N2O
포뮬러 무게:
240.3
MOL 파일:
611-92-7.mol

1,3-Dimethyl-1,3-diphenylurea 속성

녹는점
120-122 °C(lit.)
끓는 점
383.02°C (rough estimate)
밀도
1.0611 (rough estimate)
증기압
0.001Pa at 25℃
굴절률
1.6390 (estimate)
저장 조건
2-8°C
용해도
디클로로메탄(약간 용해됨), DMSO(약간 용해됨), 메탄올(매우 약간)
물리적 상태
고체
물리적 상태
단단한 모양
산도 계수 (pKa)
0.68±0.50(Predicted)
색상
흰색에서 연한 녹색
수용성
76.42mg/L at 20℃
InChI
InChI=1S/C15H16N2O/c1-16(13-9-5-3-6-10-13)15(18)17(2)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKey
ADCBKYIHQQCFHE-UHFFFAOYSA-N
SMILES
N(C)(C1=CC=CC=C1)C(N(C)C1=CC=CC=C1)=O
LogP
2.82 at 25℃
CAS 데이터베이스
611-92-7(CAS DataBase Reference)
EPA
Urea, N,N'-dimethyl-N,N'-diphenyl- (611-92-7)
안전
  • 위험 및 안전 성명
  • 위험 및 사전주의 사항 (GHS)
안전지침서 22-24/25
WGK 독일 2
RTECS 번호 FE0600000
그림문자(GHS): GHS hazard pictograms
신호 어: Warning
유해·위험 문구:
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드
H302 삼키면 유해함 급성 독성 물질 - 경구 구분 4 경고 GHS hazard pictograms P264, P270, P301+P312, P330, P501
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.
P305+P351+P338 눈에 묻으면 몇 분간 물로 조심해서 씻으시오. 가능하면 콘택트렌즈를 제거하시오. 계속 씻으시오.

1,3-Dimethyl-1,3-diphenylurea C화학적 특성, 용도, 생산

화학적 성질

Centralite II, also known as 1,3-Dimethyl-1,3-diphenylurea, is a white to grey crystalline powder that is soluble in water, alcohol, acetone, and chloroform. This substance is commonly used as a burning rate moderator and stabilizer for smokeless powder, as well as a plasticizer for celluloid.

용도

Detection of Methyl Centralite (MC) as gunshot residues (GSR) has been developed.

개요

1,3-Dimethyl-1,3-diphenylurea for Stabilizer and propellant, and production of intermediates of organic chemicals.

용도

1,3-Dimethyl-1,3-diphenylurea (methyl centralite) is a stabilizer in different types of ammunition. This compound is organic gunshot residue. It is the characteristic compound for which forensic analysts test determining if a person has discharged a firearm[1-2].

제조 방법

1,3-Dimethyl-1,3-diphenylurea can be synthesized through the reaction of methylaniline and phosgene.

주요 응용

Centralite II can be used as a stabilizer for smokeless powder, explosives, nitrates and smokeless fuels, as well as intermediates for fine chemicals.

Synthesis

To a 10 mL Schlenk tube equipped with a magnetic stirring bar was charged with arylcarbamoyl chlorides (0.2 mmol, 1.0 equiv), and KHCO3 (40 mg, 0.4 mmol), and then Pd(PPh3)4 (0.01 mmol, 11.56 mg) were added. Finally, 1,4-dioxane (1.0 mL) was added to the mixture via syringe at room temperature under N2. The tube was sealed and put into a preheated oil bath a 100 °C for 48 h. The mixture was cooled to room temperature, quenched with water (5 mL), and diluted with ethyl acetate (5 mL). The layers were separated, and the aqueous layer was extracted with 2 × 5 mL of ethyl acetate. The combined organic extracts were dried over anhydrous sodium sulfate, filtered, and concentrated in vacuo. The crude product of 1,3-dimethyl-1,3-diphenylurea was purified by flash chromatography on silica gel (H), using 30-35% ethyl acetate/petroleum ether as the eluent.

저장

Store in original tightly closed containers in a dry, cool and well-ventilated area.

1,3-Dimethyl-1,3-diphenylurea 준비 용품 및 원자재

원자재

준비 용품


1,3-Dimethyl-1,3-diphenylurea 공급 업체

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