기본 정보
- CAS
187240-78-4- 표준 SMILES
CC(C)(C)OC(=O)CN1CCN(C(=O)OCc2ccccc2)CCN(CC(=O)OC(C)(C)C)CCN(C(=O)OCc2ccccc2)CC1- InChIKey
PTOCDYCQAODDEI-UHFFFAOYSA-N- 분자식
- C36H52N4O8
- 평균 분자량
- 668.8 g/mol
이름 및 식별자
- 우선 이름
- 1,7-Bis(1,1-dimethylethyl) 4,10-bis[(phenylmethoxy)carbonyl]-1,4,7,10-tetraazacyclododecane-1,7-diacetate
- IUPAC
- dibenzyl 4,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododecane-1,7-dicarboxylate
- 영어명
- 1,4,7,10-Tetraazacyclododecane-1,7-diacetic acid, 4,10-bis[(phenylmethoxy)carbonyl]-, 1,7-bis(1,1-dimethylethyl) ester
- 분자식
- C36H52N4O8
- 분자량
- 668.82
이름 및 동의어
187240-78-41,7-Bis(1,1-dimethylethyl) 4,10-bis[(phenylmethoxy)carbonyl]-1,4,7,10-tetraazacyclododecane-1,7-diacetateDibenzyl 4,10-Bis[2-(tert-butoxy)-2-oxoethyl]-1,4,7,10-tetraazacyclododecane-1,7-dicarboxylateDibenzyl 4,10-bis(2-(tert-butoxy)-2-oxoethyl)-1,4,7,10-tetraazacyclododecane-1,7-dicarboxylateSCHEMBL10316948PTOCDYCQAODDEI-UHFFFAOYSA-NSY2860801,7-bis-(benzyloxycarbonyl)-4,10-bis(carbo-tert-butoxymethyl)-1,4,7,10-tetraaza cyclododecane1,7-bis-(benzyloxycarbonyl)-4,10-bis(carbo-tert-butoxymethyl)-1,4,7,10-tetraazacyclododecane1,4,7,10-Tetraazacyclododecane-1，7-diaceticacid,4,10-bis((1,7-dibenzyl 4,10-bis[2-(tert-butoxy)-2-oxoethyl]-1,4,7,10-tetraazacyclododecane-1,7-dicarboxylate1,4,7,10-Tetraazacyclododecane-1,7-diacetic acid, 4,10-bis[(phenylmethoxy)carbonyl]-, 1,7-bis(1,1-dimethylethyl) ester
데이터베이스 식별자
- CAS
187240-78-4- Nikkaji
- J879.070A
물성
구조 계산 물성
- XLogP
- 4.7
- 극성 표면적
- 118 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 14
- 무거운 원자 수
- 48
- 형식 전하
- 0
- 복잡도
- 918
화학 및 산업
공급사11 곳
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GL Biochem (Shanghai) Ltd.+86-021-61263370 +86-18901917034
吉尔多肽生物制药（大连市）有限公司021-61263455 13167021076 · [email protected]
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