CAS 214360-70-0 4,4,5,5-Tetramethyl-2-(thiophen-3-yl)-1,3,2-dioxaborolane (HCID 2760597)

기본 정보

CAS: 214360-70-0
표준 SMILES: CC1(C)OB(c2ccsc2)OC1(C)C
InChIKey: HQXQOBAEDQBINI-UHFFFAOYSA-N
분자식: C10H15BO2S
평균 분자량: 210.11 g/mol
단동위원소 질량: 210.08858112

이름 및 식별자

우선 이름: 4,4,5,5-Tetramethyl-2-(thiophen-3-yl)-1,3,2-dioxaborolane
IUPAC: 4,4,5,5-tetramethyl-2-thiophen-3-yl-1,3,2-dioxaborolane
현지명: 티오펜-3-보론산피나콜에스테르
영어명: Thiophene-3-boronic acid pinacol ester
분자식: C10H15BO2S
분자량: 210.1

이름 및 동의어

214360-70-04,4,5,5-tetramethyl-2-(thiophen-3-yl)-1,3,2-dioxaborolaneDTXSID10375251RefChem:284848DTXCID30326280674-923-84,4,5,5-Tetramethyl-2-(3-thienyl)-1,3,2-dioxaborolanethiophene-3-boronic acid pinacol esterthiophene-3-boronic acid, pinacol ester4,4,5,5-tetramethyl-2-thiophen-3-yl-1,3,2-dioxaborolane3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiopheneMFCD05663893

이름 더 보기

티오펜-3-보론산피나콜에스테르4,4,5,5-Tetramethyl-2-(tThiophene-3-boronic acid pinacal esteThiophene-3-boronic acid pinacal ester3-THIOPHENEBORONIC ACID, PINACOL ESTER4,4,5,5-Tetramethyl-2-(thien-3-yl)-1,3,2-dioxaborolane

1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-(3-thienyl)-3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-thiophene3-Thiopheneboronic acid pinacol esterSCHEMBL1033417HQXQOBAEDQBINI-UHFFFAOYSA-NAKOS015950768AB22039AS-2654

데이터베이스 식별자

CAS: 214360-70-0
PubChem CID: 2760597
DTXSID: DTXSID10375251
EC Number: 674-923-8
Nikkaji: J1.304.183K

물성

구조 계산 물성

극성 표면적: 46.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 14
형식 전하: 0
복잡도: 214

물리화학적 성질

녹는점: 72 · 72-73 °C
끓는 점: 286.5 · 286.5±13.0 °C(Predicted)
밀도: 1.07 · 1.07±0.1 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
물리적 상태: 고체
색상: 흰색에서 황백색까지

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): 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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.