HRID500100

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7918

Acetic anhydride

C4H6O3

结构：CC1(CCCCS(=O)(=O)O)C=[N+](CCCCCC(=O)O)c2c(F)c(F)c(F)c(F)c21

HCID86646190

未命名化合物

PRODUCTS

生成物

$结构：CC1(CCCCS(=O)(=O)O)/C(=C\C=C\C=C\C=N\c2ccccc2)N(CCCCCC(=O)O)c2c(F)c(F)c(F)c(F)c21$

HCID178425986

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID176

Acetic Acid

C2H4O2

CONDITIONS

反应条件

温度: 120 °C

PROCEDURE

实验过程

To 1-(5-carboxypentyl)-4,5,6,7-tetrafluoro-3-methyl-3-(4-sulfobutyl)-3H-indolium (24 mg) was added N-[5-(phenylamino)-2,4-pentadienylidene monohydrochloride (13 mg), acetic anhydride (4 ml) and acetic acid (2 ml). This mixture was heated to 120° C. for 1 hour 45 minutes after which time it was cooled to room temperature. This crude reaction mixture (ca. 5 mg/ml product) was used without purification as further described.

WORKUP

后处理

temperaturewas cooled to room temperature
customThis crude reaction mixture (ca. 5 mg/ml product)
customwas used without purification

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d76e5b6aa19f4ad18e9cdfe426c3c4de
来源数据集: uspto-grants-2010_08
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07767829B2
来源说明: uspto-grants-2010_08

反应 SMILES

[C:1]([CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][N+:9]1[C:17]2[C:12](=[C:13]([F:21])[C:14]([F:20])=[C:15]([F:19])[C:16]=2[F:18])[C:11]([CH3:30])([CH2:22][CH2:23][CH2:24][CH2:25][S:26]([OH:29])(=[O:28])=[O:27])[CH:10]=1)([OH:3])=[O:2].C(O[C:35](=O)[CH3:36])(=O)C>C(O)(=O)C>[F:21][C:13]1[C:14]([F:20])=[C:15]([F:19])[C:16]([F:18])=[C:17]2[C:12]=1[C:11]([CH3:30])([CH2:22][CH2:23][CH2:24][CH2:25][S:26]([OH:29])(=[O:28])=[O:27])/[C:10](=[CH:1]\[CH:4]=[CH:5]\[CH:6]=[CH:7]\[CH:8]=[N:9]\[C:35]1[CH:36]=[CH:13][CH:12]=[CH:11][CH:10]=1)/[N:9]2[CH2:8][CH2:7][CH2:6][CH2:5][CH2:4][C:1]([OH:3])=[O:2]