1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-3-(3-(trifluoromethyl)phenyl)urea

HCID 16125103

기본 정보

표준 SMILES
CC1(C)OB(c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)cc2)OC1(C)C
InChIKey
YNESXENNYVJJQN-UHFFFAOYSA-N
분자식
C20H22BF3N2O3
평균 분자량
406.2 g/mol
단동위원소 질량
406.1675572

이름 및 식별자

우선 이름
1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-3-(3-(trifluoromethyl)phenyl)urea
IUPAC
1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea

이름 및 동의어

796967-48-11-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-3-(3-(trifluoromethyl)phenyl)urea1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[3-(trifluoromethyl)phenyl]ureaSCHEMBL59604C20H22BF3N2O3MFCD15530091AS-76921DA-02697D93570F817508A1-281261-(4-(4455-tetramethyl-132-dioxaborolan-2-yl)phenyl)-3-(3-(trifluoromethyl)phenyl)urea
이름 더 보기
1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-3-(3-(trifluoro methyl)phenyl)urea1-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-3-(3-trifluoromethyl-phenyl)-ureaN-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-N'-[3-(trifluoromethyl)-phenyl]urean-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-n'-[3-(trifluoromethyl)phenyl]urea

데이터베이스 식별자

PubChem CID
16125103

물성

구조 계산 물성

극성 표면적
59.6 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
6
회전 가능 결합 수
3
무거운 원자 수
29

관련 반응

25건

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