2,5-Dibromo-3-nitropyridine

HCID 298470CAS 15862-37-0

기본 정보

표준 SMILES
O=[N+]([O-])c1cc(Br)cnc1Br
InChIKey
OQKWPJCAKRVADO-UHFFFAOYSA-N
분자식
C5H2Br2N2O2
평균 분자량
281.89 g/mol
단동위원소 질량
279.8483015

이름 및 식별자

우선 이름
2,5-Dibromo-3-nitropyridine
IUPAC
2,5-dibromo-3-nitropyridine
영어명
2,5-Dibromo-3-nitropyridine
분자식
C5H2Br2N2O2
분자량
281.89

이름 및 동의어

2,5-Dibromo-3-nitropyridine15862-37-0DTXSID20305387RefChem:82768DTXCID70256517808-084-82,5-Dibromo-3-nitro-pyridineMFCD09266223PYRIDINE, 2,5-DIBROMO-3-NITRO-NSC170627SCHEMBL202290SCHEMBL29600703
이름 더 보기
5-Dibromo-3-nitropyridine2,5-Dibromo-3-nitropyridi...Pyridine,2,5-dibroMo-3-nitro-2,5-Dibromo-3-nitropyridine,98%2,5-Dibromo-3-nitropyridine >2,5-Dibromo-3-nitropyridine ,97%2,5-Dibromo-3-nitropyridine ISO 9001:2015 REACH
OQKWPJCAKRVADO-UHFFFAOYSA-NSBB065287AKOS005255313CS-W003617DS-0464NSC 170627NSC-170627PB16150

데이터베이스 식별자

CAS
15862-37-0
PubChem CID
298470
DTXSID
DTXSID20305387
EC Number
808-084-8
Nikkaji
J1.453.077K

물성

구조 계산 물성

XLogP
2.4
극성 표면적
58.7 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
0
무거운 원자 수
11

물리화학적 성질

녹는점
92 to · 92.0 to 96.0 °C
끓는 점
272.7 · 272.7±35.0 °C(Predicted)
밀도
2 · 2+-.0.06 g/cm3(Predicted)
저장 조건
2 · under inert gas (nitrogen or Argon) at 2–8 °C
용해도
메탄올에 용해됨
산도 계수 (pKa)
-5.6 · -5.60±0.20(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (33.3%)

안전 데이터

wgk
3
ridadr
UN 2811 6.1 / PGIII
HS 번호
2933399990
risk_code
25
hazard_code
Xi,T
safety_code
45

화학 및 산업

응용 분야

용도2,5-Dibromo-3-nitropyridine is used as organic synthesis intermediate and pharmaceutical intermediate, mainly used in laboratory research and development process and chemical production process.

제조 방법 · 1건

synthesis of 2,5-Dibromo-3-nitropyridine: To a suspension 5-bromo-3-nitro-pyridin-2-ol (20 g, 91.32 mmol) in toluene (100 ml) was added DMF (0.7 ml, 9.13 mmol) and the mixture was heated to 90C. (the reaction mixture was protected from light). A solution of POBr3 (31. 41 g, 109.51 mmol) in toluene (40 ml) was added dropwise at 90C. and the reaction mixture was stirred at that temperature for 16 h. The mixture was allowed to cool to room temperature and toluene (50 ml) and water (50 ml) were added. The organic layer was separated, washed successively with aqueous 1N NaOH (60 ml), water (60 ml) and brine (30 ml), dried with Na2SO4 and evaporated obtain 2,5-Dibromo-3-nitropyridine. Yellow solid, yield 25.2 g, 97%.

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]

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