3-(4-fluorophenyl)-1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole (HCID 67073806)

기본 정보

표준 SMILES: Cn1cc(B2OC(C)(C)C(C)(C)O2)c(-c2ccc(F)cc2)n1
InChIKey: PNSUWULMJBJLLX-UHFFFAOYSA-N
분자식: C16H20BFN2O2
평균 분자량: 302.2 g/mol
단동위원소 질량: 302.1601862

이름 및 식별자

우선 이름: 3-(4-fluorophenyl)-1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
IUPAC: 3-(4-fluorophenyl)-1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole

이름 및 동의어

1286230-78-13-(4-fluorophenyl)-1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazoleMFCD225722683-(4-fluorophenyl)-1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole1H-Pyrazole, 3-(4-fluorophenyl)-1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-SCHEMBL1554395PNSUWULMJBJLLX-UHFFFAOYSA-NSY267031WS-00139DB-135543D85542[3-(4-Fluorophenyl)-1-methyl-1H-pyrazol-4-yl]boronic Acid Pinacol Ester

이름 더 보기

3-(4-Fluorophenyl)-1-methyl-1H-pyrazole-4-boronic Acid Pinacol Ester3-(4-Fluorophenyl)-1-methyl-4-(4455-tetramethyl-132-dioxaborolan-2-yl)-1H-pyrazole3-(4-Fluorophenyl)-1-methyl-4-(4 pound not4 pound not5 pound not5-tetramethyl-1 pound not3 pound not2-dioxaborolan-2-yl)-1H-pyrazole

데이터베이스 식별자

PubChem CID: 67073806
Nikkaji: J3.331.062E

물성

구조 계산 물성

극성 표면적: 36.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 22
형식 전하: 0
복잡도: 397

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