1-ethyl-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

HCID 68995348

기본 정보

표준 SMILES
CCn1cc(B2OC(C)(C)C(C)(C)O2)c(-c2ccc([N+](=O)[O-])cc2)n1
InChIKey
BNJLOSTYUZRZME-UHFFFAOYSA-N
분자식
C17H22BN3O4
평균 분자량
343.2 g/mol

이름 및 식별자

우선 이름
1-ethyl-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
IUPAC
1-ethyl-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole

이름 및 동의어

942920-11-81-ethyl-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole1-ethyl-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazoleMFCD12400854SCHEMBL4305414C17H22BN3O4BNJLOSTYUZRZME-UHFFFAOYSA-NCS-M0101AKOS030621713CS-13313DA-29420SY355794
이름 더 보기
A50969F7884861-Ethyl-3-(4-nitrophenyl)-1H-pyrazole-4-boronic Acid Pinacol Ester1-Ethyl-3-(4-nitrophenyl)-pyrazole-4-boronic Acid Pinacol Ester1-ethyl-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1H-pyrazole1-ethyl-3-(4-nitrophenyl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole3-(4-nitrophenyl)-1-ethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

데이터베이스 식별자

PubChem CID
68995348

물성

구조 계산 물성

극성 표면적
82.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
3
무거운 원자 수
25

관련 반응

40건

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