CAS 400024-08-0 Ethyl 2-(2-chlorobenzylidene)-4-(2-(1,3-dioxoisoindolin-2-yl)ethoxy)-3-oxobutanoate (HCID 53879087)

기본 정보

CAS: 400024-08-0
표준 SMILES: CCOC(=O)C(=Cc1ccccc1Cl)C(=O)COCCN1C(=O)c2ccccc2C1=O
InChIKey: HIMWFGTVILLKOV-UHFFFAOYSA-N
분자식: C23H20ClNO6
평균 분자량: 441.9 g/mol

이름 및 식별자

우선 이름: Ethyl 2-(2-chlorobenzylidene)-4-(2-(1,3-dioxoisoindolin-2-yl)ethoxy)-3-oxobutanoate
IUPAC: ethyl 2-[(2-chlorophenyl)methylidene]-4-[2-(1,3-dioxoisoindol-2-yl)ethoxy]-3-oxobutanoate
영어명: 2-[(2-Chlorophenyl)Methylene]-4-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethoxy]-3-oxobutanoic Acid Ethyl Ester
분자식: C23H20ClNO6
분자량: 441.86

이름 및 동의어

Amlodipine Impurity U400024-08-0Ethyl 2-(2-chlorobenzylidene)-4-(2-(1,3-dioxoisoindolin-2-yl)ethoxy)-3-oxobutanoateethyl 2-(o-chlorobenzylidene)-4-(2-phthalimidoethoxy)acetoacetate2-[(2-Chlorophenyl)methylene]-4-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethoxy]-3-oxobutanoic Acid Ethyl EsterAmlodipine Impurity 202A6UJ67VPSSCHEMBL4985816HIMWFGTVILLKOV-UHFFFAOYSA-NButanoic acid, 2-[(2-chlorophenyl)methylene]-4-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethoxy]-3-oxo-, ethyl esterAmlodipine Impurity 51Amlodipine EP Impurity U

이름 더 보기

Amlodipine IH Impurity BAmlodipine impurities1731Amlodipine Related Compound (E-Isomer)Ethyl-2-(2-chlorobenzylidine)-4-[2 (phthalimido)ethoxy] Acetoacetate2-[(2-CHLOROPHENYL)METHYLENE]-4-[2-(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOL-2-YL)ETHOXY]-3-OXOBUTANOIC ACI

물성

구조 계산 물성

XLogP: 3.6
극성 표면적: 90 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 6
회전 가능 결합 수: 10
무거운 원자 수: 31
형식 전하: 0
복잡도: 712

물리화학적 성질

용해도: 클로로포름(약간 용해됨), 에틸아세테이트(약간 용해됨)
물리적 상태: 기름
색상: 진한 노란색에서 주황색까지 투명

화학 및 산업

응용 분야

용도2-[(2-Chlorophenyl)methylene]-4-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethoxy]-3-oxobutanoic Acid Ethyl Ester is an intermediate in the synthesis of Amlodipine Besilate (A633500) related compounds.