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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 736500생성일: 2026년 10월 23일

1-Benzothiophene-2-carbaldehyde

BENZO[B]THIOPHENE-2-CARBALDEHYDE · BENZOTHIOPHENE-2-CARBALDEHYDE · 2-FO · AKOS BC-0216 · BUTTPARK 98\04-19 · RARECHEM AM LA 0005 · 2-FORMYLBENZO[B]THIOPHENE · Benzo[b]thiophene-2-carboxaL

https://huagongshe.com/ko/chemical/736500

1-Benzothiophene-2-carbaldehyde 분자 구조식

식별자 및 물리적 특성

CAS No.3541-37-5
분자식C9H6OS
평균 분자량162.21 g/mol
단동위원소 질량162.01393598 g/mol
SMILESO=Cc1cc2ccccc2s1
InChIKeyNXSVNPSWARVMAY-UHFFFAOYSA-N
PubChem CID736500
ChEMBLCHEMBL3358202
EC No.627-681-2
DTXSIDDTXSID00353043

화학 및 물리적 성질

XLogP2.7
극성 표면적45.3
수소 결합 공여자 수0
수소 결합 수용자 수2
회전 가능 결합 수1
무거운 원자 수11
형식 전하0
복잡도158
녹는점32-36 °C
끓는 점90°C 0,1mm
밀도1.300±0.06 g/cm3(Predicted)
인화점135-136°C/8mm
저장 조건Keep in dark place,Sealed in dry,Room Temperature
용해도메탄올에 용해됨
물리적 상태powder to lump
색상White to Orange to Green
BRN114170
InChI1S/C9H6OS/c10-6-8-5-7-3-1-2-4-9(7)11-8/h1-6H
InChIKeyNXSVNPSWARVMAY-UHFFFAOYSA-N
SMILESO=Cc1cc2ccccc2s1

화학적 성질

White to light brown solid

안전 및 규제

GHS 분류WarningH319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)Aggregated GHS information provided per 67 reports by companies from 2 notifications to the ECHA C&L Inventory.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.
Hazard Classes and CategoriesEye Irrit. 2A (100%)
수질 위해 등급(WGK)3
관세 코드29349990
위험 문구(R)36/37/38
위험 표시Xi
안전 문구(S)26-36/37/39-24/25-22
위험 참고 사항Irritant
저장 분류11 - Combustible Solids

용도

용도

Preparation of the corresponding vinyl benzyl ether using Julia olefination.