4-(2-브로모-에틸)-3,5-디메틸-1H-피라졸

4-(2-Bromoethyl)-3,5-dimethyl-1H-pyrazole

HCID 572879

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 83467-28-1
표준 SMILES: Cc1n[nH]c(C)c1CCBr
InChIKey: HGGLMDBNLJUEKA-UHFFFAOYSA-N
분자식: C7H11BrN2
평균 분자량: 203.08 g/mol
단동위원소 질량: 202.01056045

이름 및 식별자

우선 이름: 4-(2-Bromoethyl)-3,5-dimethyl-1H-pyrazole
IUPAC: 4-(2-bromoethyl)-3,5-dimethyl-1H-pyrazole
현지명: 4-(2-브로모-에틸)-3,5-디메틸-1H-피라졸
영어명: 4-(2-Bromo-ethyl)-3,5-dimethyl-1H-pyrazole
분자식: C7H11BrN2
분자량: 203.08

이름 및 동의어

4-(2-Bromoethyl)-3,5-dimethyl-1H-pyrazole83467-28-1DTXSID10341411RefChem:287110DTXCID90292492695-914-54-(2-Bromo-ethyl)-3,5-dimethyl-1H-pyrazole3,5-Dimethyl-4-(2-bromoethyl)-1H-pyrazole4-(2-Bromoethyl)-3,5-dimethyl-1H-pyrazolMFCD004809874-(2-bromoethyl)-3,5-dimethylpyrazole1H-Pyrazole, 4-(2-bromoethyl)-3,5-dimethyl-

이름 더 보기

4-(2-브로모-에틸)-3,5-디메틸-1H-피라졸AKOS PAO-0750TIMTEC-BB SBB0101555-DiMethyl-4-(2-broMoethyl)-1H-pyrazole4-(2-Bromoethyl)-3,5-dimethyl-4H-pyrazole3,5-DIMETHYL-4'-(2-BROMOETHYL)-1H-PYRAZOLE4-(2-bromoethyl)-3,5-dimethyl-1H-pyrazole(SALTDATA: FREE)

SCHEMBL1660409SBB010155STL069455AKOS000365664AS-11305BP-111884-(Bromoethyl)-3,5-dimethyl-1H-pyrazoleDB-075934

데이터베이스 식별자

CAS: 83467-28-1
PubChem CID: 572879
DTXSID: DTXSID10341411
EC Number: 695-914-5
Nikkaji: J3.594.767A

물성

구조 계산 물성

XLogP: 2
극성 표면적: 28.7 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 108

물리화학적 성질

녹는점: 127 · 127-128 °C
끓는 점: 308.4 · 308.4±37.0 °C(Predicted)
밀도: 1.455 · 1.455±0.06 g/cm3(Predicted)
산도 계수 (pKa): 15.33 · 15.33±0.50(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, 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.