3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonic acid
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3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonic acid 속성
- 녹는점
- 97-99℃
- 끓는 점
- 402.0±45.0 °C(Predicted)
- 밀도
- 1.35
- 저장 조건
- under inert gas (nitrogen or Argon) at 2-8°C
- 물리적 상태
- 고체
- 물리적 상태
- 단단한 모양
- 색상
- 하얀색
- InChI
- InChI=1S/C10H11O5P/c1-13-16(12,14-2)10-8-6-4-3-5-7(8)9(11)15-10/h3-6,10H,1-2H3
- InChIKey
- KEKUNQAVGWOYDW-UHFFFAOYSA-N
- SMILES
- P(C1C2=C(C=CC=C2)C(=O)O1)(=O)(OC)OC
안전
- 위험 및 안전 성명
- 위험 및 사전주의 사항 (GHS)
HS 번호 | 2932990090 |
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신호 어: | Warning | ||||||||||||||||||||||||||||
유해·위험 문구: |
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예방조치문구: |
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3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonic acid C화학적 특성, 용도, 생산
용도
Dimethyl (3-oxo-1,3-dihydroisobenzofuran-1-yl)phosphonate is a reagent used in the synthesis of 4-[3-(4-Cyclopropanecarbonylpiperazine-1-carbonyl)-4-fluorobenzyl]-2H-phthalazin-1-one, an inhibitor of both PARP-1 AND PARP-2 that shows standalone activity against BRCA1-deficient breast cancer cell lines.Synthesis
Sodium methoxide (2.28 g,0.042 mol) was dissolved in methanol (40 mL) into a 150 mLround-bottom flask. To this solution, dimethyl hydrogen phosphite(4.8 mL, 0.049 mol) and 2-carboxybenzaldehyde (compound5, 5.00 g, 0.033 mol) were added by dripping at 0 °Cfor 30 min. Then the mixture was stirred at room temperaturefor 8 h.After the reaction was completed, methanesulfonicacid (3.1 mL, 0.047 mol) was added dropwise and stirred for30 min. The solvent was removed under reduced pressure,following by adding 40 mol water.
The aqueous phase wasextracted with dichloromethane for three times, the combinedorganic phase was washed with water until neutral and driedwith anhydrous sodium sulfate. Dichloromethane was evaporatedunder reduced pressure to afford 3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonic acid(4.93 g, 99%)as white solid.
1H-NMR (500 MHz, DMSO-d6) δ: 3.62 (3H,d, J = 8 Hz), 3.86 (3H, d, J = 12 Hz), 6.36 (1H, d, J = 8 Hz),7.74-7.70 (2H, m), 7.91-7.88 (1H, m), 7.98-7.96 (1H, m).
3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonic acid 준비 용품 및 원자재
원자재
1(3H)-Isobenzofuranone, 3-hydroxy-
methyl 2-iodo-3-methoxybenzoate
N,N-DIETHYLBENZAMIDE
다이메틸 인산염
황산
메틸알콜
메틸산 나트륨
2-Carboxybenzaldehyde
다이메틸 히드로겐 포스피트
준비 용품
3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonic acid 공급 업체
글로벌( 168)공급 업체
공급자 | 전화 | 이메일 | 국가 | 제품 수 | 이점 |
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PharmOrgSyn Laboratories Co., Ltd. | +86-021-38228826 +86-13916602830 |
sales@pharmorgsyn.cn | China | 140 | 58 |
Capot Chemical Co.,Ltd. | 571-85586718 +8613336195806 |
sales@capotchem.com | China | 29797 | 60 |
Shanghai Daken Advanced Materials Co.,Ltd | +86-371-66670886 |
info@dakenam.com | China | 15928 | 58 |
Beijing Cooperate Pharmaceutical Co.,Ltd | 010-60279497 |
sales01@cooperate-pharm.com | CHINA | 1811 | 55 |
Anqing Chico Pharmaceutical Co., Ltd. | 15380796838 |
chloewu@chicopharm.cn | CHINA | 341 | 58 |
career henan chemical co | +86-0371-86658258 |
sales@coreychem.com | China | 29914 | 58 |
SHANDONG ZHI SHANG CHEMICAL CO.LTD | +86 18953170293 |
sales@sdzschem.com | China | 2931 | 58 |
Standardpharm Co. Ltd. | 86-714-3992388 |
overseasales1@yongstandards.com | United States | 14336 | 58 |
Chongqing Chemdad Co., Ltd | +86-023-61398051 +8613650506873 |
sales@chemdad.com | China | 39916 | 58 |
Alchem Pharmtech,Inc. | 8485655694 |
sales@alchempharmtech.com | United States | 63711 | 58 |
3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonic acid 관련 검색:
시클로프로판카복산에틸에스테르 이소프로필브로마이드 피페라진 디하이드로클로라이드
2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)Methyl)benzoic acid
2-Fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)Methyl)benzonitrile
1,3-DiMethyl 2-[4-(Methoxycarbonyl)-2-nitrophenyl]propanedioate
tert-butyl 4-(2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)Methyl)benzoyl)piperazine-1-carboxylate
2-Fluoro-5-((3-oxoisobenzofuran-1(3H)-ylidene)methyl)benzonitrile
1-(CYCLOPROPANECARBONYL)PIPERAZINE 97
Piperazine, 1-(cyclopropylcarbonyl)-, Monohydrochloride
Olaparib
Olaparib Imp.2
Olaparib Metabolite M12
Olaparib Impurity 22
Olaparib impurity 1
3-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)benzoic acid
tert-Butyl 1-piperazinecarboxylate
tert-butyl 4-(cyclopropylcarbonyl)-1-piperazinecarboxylate