N-cyclopropylmethyl-4-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzamide

HCID 21914588

기본 정보

표준 SMILES
Cc1ccc(C(=O)NCC2CC2)cc1B1OC(C)(C)C(C)(C)O1
InChIKey
QMNHRHWOJSWJJV-UHFFFAOYSA-N
분자식
C18H26BNO3
평균 분자량
315.2 g/mol
단동위원소 질량
315.2005739

이름 및 식별자

우선 이름
N-cyclopropylmethyl-4-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzamide
IUPAC
N-(cyclopropylmethyl)-4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide

이름 및 동의어

SCHEMBL1233325QMNHRHWOJSWJJV-UHFFFAOYSA-NDB-403435N-(cyclopropylmethyl)-4-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzamideN-(cyclopropylmethyl)-4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamideN-cyclopropylmethyl-4-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]-dioxaborolan-2-yl)benzamideN-cyclopropylmethyl-4-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzamideN-cyclopropylmethyl-4methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzamide585544-08-7

데이터베이스 식별자

PubChem CID
21914588

물성

구조 계산 물성

극성 표면적
47.6 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
4
무거운 원자 수
23

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39건

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