147427-70-1 | BENZOTHIAZOLIUM, 2-[[5,5-DIMETHYL-3-[[3-(3-SULFOPROPYL)-2(3H)-BENZOTHIAZOLYLIDENE]METHYL]-2-CYCLOHEXEN-1-YLIDENE]METHYL]-3-(3-SULFOPROPYL)-, INNER SALT, N,N-DIETHYLETHANAMINE (1:1) ,CCD00541142,MFCD06409797 - Product Detail

列表 147427-70-1

新版本

CCD编号 : CCD00541142
CAS号 : 147427-70-1
产品英文名称 : BENZOTHIAZOLIUM, 2-[[5,5-DIMETHYL-3-[[3-(3-SULFOPROPYL)-2(3H)-BENZOTHIAZOLYLIDENE]METHYL]-2-CYCLOHEXEN-1-YLIDENE]METHYL]-3-(3-SULFOPROPYL)-, INNER SALT, N,N-DIETHYLETHANAMINE (1:1)
MDL号 : MFCD06409797
分子式 : C30 H34 N2 O6 S4 . C6 H15 N
分子量 : 748.062
同义词 :
BENZOTHIAZOLIUM, 2-[[5,5-DIMETHYL-3-[[3-(3-SULFOPROPYL)-2(3H)-BENZOTHIAZOLYLIDENE]METHYL]-2-CYCLOHEXEN-1-YLIDENE]METHYL]-3-(3-SULFOPROPYL)-, INNER SALT, N,N-DIETHYLETHANAMINE (1:1);
Mol : BENZOTHIAZOLIUM, … .mol

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基本信息
产品名称：	BENZOTHIAZOLIUM, 2-[[5,5-DIMETHYL-3-[[3-(3-SULFOPROPYL)-2(3H)-BENZOTHIAZOLYLIDENE]METHYL]-2-CYCLOHEXEN-1-YLIDENE]METHYL]-3-(3-SULFOPROPYL)-, INNER SALT, N,N-DIETHYLETHANAMINE (1:1)
CAS：	147427-70-1
英文同义词：	BENZOTHIAZOLIUM, 2-[[5,5-DIMETHYL-3-[[3-(3-SULFOPROPYL)-2(3H)-BENZOTHIAZOLYLIDENE]METHYL]-2-CYCLOHEXEN-1-YLIDENE]METHYL]-3-(3-SULFOPROPYL)-, INNER SALT, N,N-DIETHYLETHANAMINE (1:1)
MDL号：	MFCD06409797
氢键受体数量：	8
氢键供体数量：	1
Smile：	CCN(CC)CC.CC1(CC(=C/C(=C/c2[n+](c3ccccc3s2)CCCS(=O)(=O)[O-])/C1)/C=C\4/N(c5ccccc5S4)CCCS(=O)(=O)O)C
InChi：	InChI=1S/C30H34N2O6S4.C6H15N/c1-30(2)20-22(18-28-31(13-7-15-41(33,34)35)24-9-3-5-11-26(24)39-28)17-23(21-30)19-29-32(14-8-16-42(36,37)38)25-10-4-6-12-27(25)40-29;1-4-7(5-2)6-3/h3-6,9-12,17-19H,7-8,13-16,20-21H2,1-2H3,(H-,33,34,35,36,37,38);4-6H2,1-3H3
InChiKey：	InChIKey=MIZQCSHRKPVLCG-UHFFFAOYSA-N

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