N,N'-(((4S,5S)-2-(tert-Butyl)-2-methyl-1,3-dioxolane-4,5-diyl)bis(methylene))bis(N-(4-methoxybenzyl)-1-(4-methoxyphenyl)-N-methylmethanaminium) iodide
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기본 정보
- CAS
515871-33-7- 표준 SMILES
COc1ccc(C[N+](C)(Cc2ccc(OC)cc2)C[C@@H]2OC(C)(C(C)(C)C)O[C@H]2C[N+](C)(Cc2ccc(OC)cc2)Cc2ccc(OC)cc2)cc1.[I-].[I-]- InChIKey
MLPLPMKXZJRMFD-ZLIAPTQLSA-L- 분자식
- C44H60I2N2O6
- 평균 분자량
- 966.8 g/mol
- 단동위원소 질량
- 966.25408
이름 및 식별자
- 우선 이름
- N,N'-(((4S,5S)-2-(tert-Butyl)-2-methyl-1,3-dioxolane-4,5-diyl)bis(methylene))bis(N-(4-methoxybenzyl)-1-(4-methoxyphenyl)-N-methylmethanaminium) iodide
- IUPAC
- [(4S,5S)-5-[[bis[(4-methoxyphenyl)methyl]-methylazaniumyl]methyl]-2-tert-butyl-2-methyl-1,3-dioxolan-4-yl]methyl-bis[(4-methoxyphenyl)methyl]-methylazanium diiodide
- 영어명
- N,N-(((4S,5S)-2-(Tert-Butyl)-2-Methyl-1,3-Dioxolane-4,5-Diyl)Bis(Methylene))Bis(N-(4-Methoxybenzyl)-1-(4-Methoxyphenyl)-N-Methylmethanaminium) Iodide(WXC02416)
- 분자식
- C44H60I2N2O6
- 분자량
- 966.76594
이름 및 동의어
515871-33-7N,N'-(((4S,5S)-2-(tert-Butyl)-2-methyl-1,3-dioxolane-4,5-diyl)bis(methylene))bis(N-(4-methoxybenzyl)-1-(4-methoxyphenyl)-N-methylmethanaminium) iodide1,1'-((4S,5S)-2-(tert-Butyl)-2-methyl-1,3-dioxolane-4,5-diyl)bis(N,N-bis(4-methoxybenzyl)-N-methylmethanaminium) iodideMFCD06656097SY408553W11528N,N inverted exclamation mark -[[(4S,5S)-2-(tert-Butyl)-2-methyl-1,3-dioxolane-4,5-diyl]bis(methylene)]bis[N-(4-methoxybenzyl)-1-(4-methoxyphenyl)-N-methylmethanaminium] IodideN,N'-(((4S,5S)-2-(tert-Butyl)-2-methyl-1,3-dioxolane-4,5-diyl)bis(methylene))bis(N-(4-methoxybenzyl)-1-(4-methoxyphenyl)-N-methylmethanaminium)iodideN,N-(((4S,5S)-2-(Tert-Butyl)-2-Methyl-1,3-Dioxolane-4,5-Diyl)Bis(Methylene))Bis(N-(4-Methoxybenzyl)-1-(4-Methoxyphenyl)-N-Methylmethanaminium) Iodide[(4S,5S)-5-[[bis[(4-methoxyphenyl)methyl]-methylazaniumyl]methyl]-2-tert-butyl-2-methyl-1,3-dioxolan-4-yl]methyl-bis[(4-methoxyphenyl)methyl]-methylazaniumN,N-(((4S,5S)-2-(Tert-Butyl)-2-Methyl-1,3-Dioxolane-4,5-Diyl)Bis(Methylene))Bis(N-(4-Methoxybenzyl)-1-(4-Methoxyphenyl)-N-Methylmethanaminium) Iodide(WXC02416)
물성
구조 계산 물성보충 중
- 극성 표면적
- 55.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 17
- 무거운 원자 수
- 54
- 형식 전하
- 0
- 복잡도
- 910
물리화학적 성질
- 녹는점
- 132 · 132-135 °C
관련 반응
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