2-tert-뷰틸-4,5-다이클로로-3(2H)-피리다진온

2-Tert-butyl-4,5-dichloro-2,3-dihydropyridazin-3-one

HCID 2782225

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 84956-71-8
표준 SMILES: CC(C)(C)n1ncc(Cl)c(Cl)c1=O
InChIKey: ANFVZRTXGLHTNI-UHFFFAOYSA-N
분자식: C8H10Cl2N2O
평균 분자량: 221.08 g/mol
단동위원소 질량: 220.0170183

이름 및 식별자

우선 이름: 2-Tert-butyl-4,5-dichloro-2,3-dihydropyridazin-3-one
IUPAC: 2-tert-butyl-4,5-dichloropyridazin-3-one
현지명: 2-tert-뷰틸-4,5-다이클로로-3(2H)-피리다진온
영어명: 2-(TERT-BUTYL)-4,5-DICHLORO-2,3-DIHYDROPYRIDAZIN-3-ONE
분자식: C8H10Cl2N2O
분자량: 221.08

이름 및 동의어

2-tert-butyl-4,5-dichloro-2,3-dihydropyridazin-3-oneRefChem:483626825-562-184956-71-82-(tert-Butyl)-4,5-dichloropyridazin-3(2H)-one2-(tert-Butyl)-4,5-dichloro-3(2H)-pyridazinone2-tert-butyl-4,5-dichloropyridazin-3-oneMFCD002778763(2H)-Pyridazinone, 4,5-dichloro-2-(1,1-dimethylethyl)-2-tert-butyl-4,5-dichloro-3(2H)-pyridazinone2-t-butyl-4,5-dichloro-3(2H)-pyridazinone2-(tert-butyl)-4,5-dichloro-2-hydropyridazin-3-one

이름 더 보기

2-tert-뷰틸-4,5-다이클로로-3(2H)-피리다진온2-tert-Butyl-4,5-dichloro-2H-pyridazin-3-one4,5-DICHLORO-2-(1,1-DIMETHYLETHYL)-3(2H)-PYRIDAZINONE2-(TERT-BUTYL)-4,5-DICHLORO-2,3-DIHYDROPYRIDAZIN-3-ONE2-(TERT-BUTYL)-4,5-DICHLORO-2,3-DIHYDROPYRIDAZIN-3-ONE ISO 9001：2015 REACH

A1CMYChemDiv2_0028632-tert-Butyl-4,5-dichloropyridazin-3(2H)-one4,5-dichloro-2-tert-butyl-pyridazin-3-(2H)-oneSCHEMBL1627210DTXSID20381989HMS1377C03JDA95671

데이터베이스 식별자

CAS: 84956-71-8
PubChem CID: 2782225
DTXSID: DTXSID20381989
EC Number: 825-562-1
Nikkaji: J319.675E

물성

구조 계산 물성

XLogP: 2.1
극성 표면적: 32.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 302

물리화학적 성질

녹는점: 59 °C · 59 °C
끓는 점: 240.5 · 240.5±50.0℃ (760 Torr)
밀도: 1.32 · 1.32±0.1 g/cm3 (20 ºC 760 Torr)
인화점: 99.3 · 99.3±30.1℃
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
산도 계수 (pKa): -3.39 · -3.39±0.20(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.