6-Chloroindole (HCID 87111)

이름 및 식별자

우선 이름: 6-Chloroindole
IUPAC: 6-chloro-1H-indole
현지명: 6-클로로인돌
영어명: 6-Chloroindole
분자식: C8H6ClN
분자량: 151.59

이름 및 동의어

6-Chloroindole6-Chloro-1H-indole17422-33-2NSC-58083M4E7MR63DADTXSID70169794RefChem:104438DTXCID6092285241-449-41H-Indole, 6-chloro-MFCD00005681CHEMBL511085

이름 더 보기

6-클로로인돌NSC 580836-Chloroindole >TIMTEC-BB SBB0040596-Chloroindole, 97+%1H-Indole,6-chloro-(9CI)6-chloroindole 17422-32-26-Chloroindole in stock Factory

6-chloro indole6-chloro-indoleNSC58083EINECS 241-449-46-chlor-1H-indoleIndole, 6-chloro-6-chloro-1-H-indole6-Chloroindole, 99%

데이터베이스 식별자

CAS: 17422-33-2
PubChem CID: 87111
DTXSID: DTXSID70169794
ChEMBL: CHEMBL511085
ChEBI: CHEBI:80918
UNII: M4E7MR63DA
EC Number: 241-449-4
Nikkaji: J236.659B

물성

구조 계산 물성

XLogP: 3.2
극성 표면적: 15.8 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 0
회전 가능 결합 수: 0
무거운 원자 수: 10
형식 전하: 0
복잡도: 126

물리화학적 성질

녹는점: 87 · 87-90 °C (lit.)
끓는 점: 248.91 °C · 248.91°C (rough estimate)
밀도: 1.1976 · 1.1976 (rough estimate)
굴절률: 1.5437 · 1.5437 (estimate)
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
용해도: 물에 약간 용해됨
물리적 상태: 결정성 분말
산도 계수 (pKa): 16.1 · 16.10±0.30(Predicted)
색상: 베이지색
수용성: 약간 용해됨
BRN: 112345 · 112345
안정성: 냉장고에 보관하세요
InChI: InChI=1S/C8H6ClN/c9-7-2-1-6-3-4-10-8(6)5-7/h1-5,10H
InChIKey: YTYIMDRWPTUAHP-UHFFFAOYSA-N
SMILES: N1C2=C(C=CC(Cl)=C2)C=C1
NIST: 6 · 6-Chloroindole(17422-33-2)

화학적 성질

Light Orange Powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (10%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (10%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (10%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (90%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 10 reports by companies from 6 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.