4,4,5,5-Tetramethyl-2-(3-methyl-1-benzothiophen-2-yl)-1,3,2-dioxaborolane

HCID 59133196

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1072811-91-6
표준 SMILES: Cc1c(B2OC(C)(C)C(C)(C)O2)sc2ccccc12
InChIKey: DVHBFOOMPZZQBN-UHFFFAOYSA-N
분자식: C15H19BO2S
평균 분자량: 274.2 g/mol

이름 및 식별자

우선 이름: 4,4,5,5-Tetramethyl-2-(3-methyl-1-benzothiophen-2-yl)-1,3,2-dioxaborolane
IUPAC: 4,4,5,5-tetramethyl-2-(3-methyl-1-benzothiophen-2-yl)-1,3,2-dioxaborolane
영어명: (3-METHYLBENZO[B]THIOPHEN-2-YL)BORONIC ACID PINACOL ESTER
분자식: C15H21BO3S
분자량: 292.20144

이름 및 동의어

1072811-91-64,4,5,5-tetramethyl-2-(3-methyl-1-benzothiophen-2-yl)-1,3,2-dioxaborolaneRefChem:507102984-152-14,4,5,5-Tetramethyl-2-(3-methylbenzo[b]thiophen-2-yl)-1,3,2-dioxaborolane(3-Methylbenzo[b]thiophen-2-yl)boronic acid pinacol esterMFCD183830804,4,5,5-Tetramethyl-2-(3-methyl-benzo[b]thiophen-2-yl)[1,3,2]dioxaborolanestarbld0019755SCHEMBL594378DVHBFOOMPZZQBN-UHFFFAOYSA-NEX-A4603

이름 더 보기

3-Methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[b]thiopheneBenzo[b]thiophene, 3-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

XSB81191SY372097DB-194142CS-0369281EN300-7547428F5324313-Methylbenzothiophene-2-boronic Acid Pinacol EsterZ2049897861

데이터베이스 식별자

CAS: 1072811-91-6
PubChem CID: 59133196
EC Number: 984-152-1

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: 19
형식 전하: 0
복잡도: 342

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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.