5-Bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidine (HCID 5380710)

이름 및 식별자

우선 이름: 5-Bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidine
IUPAC: 5-bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidine
영어명: 5-Bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidine
분자식: C6H3BrClN3
분자량: 232.47

이름 및 동의어

5-Bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidineDTXSID504189395-bromo-4-chloro-7H-pyrrolo(2,3-d)pyrimidineRefChem:533674DTXCID60369786622-419-322276-95-57-Bromo-6-chloro-7-deazapurineMFCD097020294-CHLORO-5-BROMO-7H-PYRROLO[2,3-D]PYRIMIDINE5-Bromo-4-chloropyrrolo[2,3-d]pyrimidine7H-PYRROLO[2,3-D]PYRIMIDINE, 5-BROMO-4-CHLORO-

이름 더 보기

5-Bromo-4-chloro-7H-pyrro...5-broMo-4-chloro-7H-pyrrolo[25-bromo-4-chloro-7h-pyrrole [2,3-d] pyrimidine5-Bromo-4-chloro-7H-pyrrolo[2,3-D]pyrimidine ,98%JR-13964, 5-Bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidine, 95%

NSC1038015-bromo-4-chloro-1H-pyrrolo[2,3-d]pyrimidineSCHEMBL154600SCHEMBL868647CHEMBL6190721OXLMTRZWMHIZBY-UHFFFAOYSA-NCL3111AKOS015851122

데이터베이스 식별자

CAS: 22276-95-5
PubChem CID: 5380710
DTXSID: DTXSID50418939
ChEMBL: CHEMBL6190721
EC Number: 622-419-3
Nikkaji: J1.064.937D

물성

구조 계산 물성

XLogP: 2.3
극성 표면적: 41.6 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 11
형식 전하: 0
복잡도: 157

물리화학적 성질

녹는점: 221 · 221-225℃
끓는 점: 221 · 221.0±50.0 °C(Predicted)
밀도: 2.15 · 2.15±0.1 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: 고체
산도 계수 (pKa): 9.43 · 9.43±0.20(Predicted)
색상: 노란색
수용성: 물에 약간 용해됩니다.
InChI: InChI=1S/C6H3BrClN3/c7-3-1-9-6-4(3)5(8)10-2-11-6/h1-2H,(H,9,10,11)
InChIKey: OXLMTRZWMHIZBY-UHFFFAOYSA-N
SMILES: C1=NC(Cl)=C2C(Br)=CNC2=N1

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 2.4% (1 of 42) of reports.

Danger

H301 (95.2%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 4 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 1 of 42 reports by companies.；There are 3 notifications provided by 41 of 42 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (95.2%)

안전 데이터

wgk: 3
ridadr: 2811
HS 번호: 2933599590
risk_code: 22
hazard_code: Xn
포장분류: Ⅲ
위험 등급: 6.1
Hazard Classifications: Acute Tox. 3 Oral
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

응용 분야

용도It is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff.

상·하류 제품 정보

상류 원료

하류 제품

4-클로로-7H-피롤로[2,3-d]피리미딘-5-카르보니트릴 JAK3-IN-6

공급사50 곳

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

武汉贺景行生物科技有限公司027-13277920701 13277920701 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]

南京百芙利科技有限责任公司25-25-58740604 15951658055 · [email protected]

연결된 노트

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5-Bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidine

기본 정보