6-Chloro-5-nitroquinoline

HCID 4070800CAS 86984-32-9

기본 정보

표준 SMILES: O=[N+]([O-])c1c(Cl)ccc2ncccc12
InChIKey: GIMHFTJFCRTQRS-UHFFFAOYSA-N
분자식: C9H5ClN2O2
평균 분자량: 208.6 g/mol
단동위원소 질량: 208.0039551

이름 및 식별자

우선 이름: 6-Chloro-5-nitroquinoline
IUPAC: 6-chloro-5-nitroquinoline
영어명: 6-Chloro-5-nitroquinoline
분자식: C9H5ClN2O2
분자량: 208.6

이름 및 동의어

6-chloro-5-nitroquinoline86984-32-9Quinoline, 6-chloro-5-nitro-DTXSID00398999RefChem:104411DTXCID30349858660-340-6GIMHFTJFCRTQRS-UHFFFAOYSA-NMFCD000936165-Nitro-6-chloroquinoline5-nitro-6-chloro-quinolineSCHEMBL2004290

이름 더 보기

6-Chloro-5-nitroquinoline 98%6-CHLORO-5-NITROQUINOLINE ISO 9001：2015 REACH

AKOS005259257DS-0520CS-0100662Z432085074AM20070172FT-0649605A23246SB71547

데이터베이스 식별자

CAS: 86984-32-9
PubChem CID: 4070800
DTXSID: DTXSID00398999
EC Number: 660-340-6
Nikkaji: J1.077.990A

물성

구조 계산 물성

XLogP: 2.6
극성 표면적: 58.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 0
무거운 원자 수: 14
형식 전하: 0
복잡도: 231

물리화학적 성질

끓는 점: 356.7 · 356.7±27.0 °C(Predicted)
밀도: 1.484 · 1.484±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
산도 계수 (pKa): 2.02 · 2.02±0.15(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (97.4%): Toxic if swallowed [Danger Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (97.4%): Causes serious eye damage [Danger 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, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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.