Sodium 4-bromobenzene-1-sulfinate

HCID 23670685CAS 34176-08-4

기본 정보

표준 SMILES: O=S([O-])c1ccc(Br)cc1.[Na+]
InChIKey: FJSOUHVHPWODGS-UHFFFAOYSA-M
분자식: C6H4BrNaO2S
평균 분자량: 243.06 g/mol
단동위원소 질량: 241.90131

이름 및 식별자

우선 이름: Sodium 4-bromobenzene-1-sulfinate
IUPAC: sodium 4-bromobenzenesulfinate
영어명: Sodium 4-bromobenzenesulfinate
분자식: C6H4BrNaO2S
분자량: 243.05353

이름 및 동의어

Sodium 4-bromobenzene-1-sulfinate34176-08-4RefChem:887084882-251-3Sodium 4-bromobenzenesulfinateMFCD09065037sodium;4-bromobenzenesulfinateSodium 4-Bromobenzenesulfinate hydrate4-bromobenzenesulfinateSodium4-bromobenzenesulfinatesodium 4-bromophenylsulfinateSCHEMBL3015881

이름 더 보기

Sodium p-bromobenzenesulfinate4-Bromobenzene-1-sulfinic acid sodium salt

SKL658Sodium (4-Bromophenyl)sulfinatesodium;4-bromanylbenzenesulfinateFJSOUHVHPWODGS-UHFFFAOYSA-M34176-08-4(anhy)JBA17608SBB0996714-bromophenylsulfinic acid sodium salt

데이터베이스 식별자

CAS: 34176-08-4
PubChem CID: 23670685
EC Number: 882-251-3
Nikkaji: J3.220.674C

물성

구조 계산 물성

극성 표면적: 59.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 11
형식 전하: 0
복잡도: 137

물리화학적 성질

저장 조건: 2 · 2-8°C, sealed storage, away from moisture

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning 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+P317, P302+P352, P304+P340, P305+P351+P338, 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 1 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.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

안전 데이터

신호 어: Warning
유해·위험 문구: 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302

화학 및 산업

응용 분야

용도Sodium 4-Bromobenzene-1-sulfinate is used in preparation of beta-ketosulfone derivatives via radical addition/oxidation reaction of aryl olefins with sodium sulfinates.