N,N-Dimethyl 4-iodo-1H-imidazole-1-sulfonamide

HCID 2773390

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 135773-25-0
표준 SMILES: CN(C)S(=O)(=O)n1cnc(I)c1
InChIKey: HSJHNZMKMJPPGU-UHFFFAOYSA-N
분자식: C5H8IN3O2S
평균 분자량: 301.11 g/mol
단동위원소 질량: 300.9381955

이름 및 식별자

우선 이름: N,N-Dimethyl 4-iodo-1H-imidazole-1-sulfonamide
IUPAC: 4-iodo-N,N-dimethylimidazole-1-sulfonamide
영어명: N,N-Dimethyl 4-iodo-1H-imidazole-1-sulfonamide
분자식: C5H8IN3O2S
분자량: 301.11

이름 및 동의어

N,N-Dimethyl 4-iodo-1H-imidazole-1-sulfonamideRefChem:822360801-886-9135773-25-04-Iodo-N,N-dimethyl-1H-imidazole-1-sulfonamideN,N-Dimethyl-4-iodo-1H-imidazole-1-sulfonamide4-iodo-N,N-dimethylimidazole-1-sulfonamideMFCD021795434-iodo-N,N-dimethyl-imidazole-1-sulfonamideN,N-Dimethyl-4-iodo-1H-imidazole-1-sulphonamide1H-Imidazole-1-sulfonamide, 4-iodo-N,N-dimethyl-SCHEMBL2383891

이름 더 보기

N,N-Dimethyl 4-iodo-1H-imidazole-1-(Dimethylsulfamoyl)-4-iodo-1H-imidazoleN,N-DIMENTHYL-4-IODO-1H-IMIDAZOLE-1SULFONAN,N-Dimethyl-4-iodo-1H-imidazol-1-sulfonamideN,N-DIMETHYL 4-IODO-1H-IMIDAZOLE-1-SULPHONAMIDEN,N-DIMETHYL 4-IODO-1H-IMIDAZOLE-1-SULFONAMIDE USP/EP/BP

HSJHNZMKMJPPGU-UHFFFAOYSA-DTXSID10378429HSJHNZMKMJPPGU-UHFFFAOYSA-NAKOS015853972AB11335AS-17908SY2681401-(N,N-dimethylsulfamoyl)-4-iodoimidazole

데이터베이스 식별자

CAS: 135773-25-0
PubChem CID: 2773390
DTXSID: DTXSID10378429
EC Number: 801-886-9
Nikkaji: J427.136J

물성

구조 계산 물성

XLogP: 0.3
극성 표면적: 63.6 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 12
형식 전하: 0
복잡도: 248

물리화학적 성질

녹는점: 119 · 119-122°C
끓는 점: 387.3 · 387.3±34.0 °C(Predicted)
밀도: 2.04 · 2.04±0.1 g/cm3(Predicted)
저장 조건: 2 · Keep in dark place,Inert atmosphere,2-8°C
물리적 상태: 고체
산도 계수 (pKa): -0.04 · -0.04±0.61(Predicted)
색상: 하얀색

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.