蔗糖苯酸

CAS号
2425-84-5
CCD编号
CCD00031623
分子式
C68 H54 O19
分子量
1175.16

基本信息

产品名称: 蔗糖苯酸
CAS: 2425-84-5
中文同义词: 蔗糖苯甲酸酯 ; 蔗糖苯酸 ; 3-(2-硝基苯基)吡啶
英文同义词: ALPHA-D-GLUCOPYRANOSYL-BETA-D-FRUCTOFURANOSIDE BENZOATE ; SUCROSE BENZOATE ; A-D-GLUCOPYRANOSYL-B-D-FRUCTOFURANOSIDE BENZOATE ; SUCROSE OCTABENZOATE ; 1-O-BENZOYL-BETA-D-FRUCTOFURANOSYL ALPHA-D-GLUCOPYRANOSIDE ; SACCHAROSE BENZOATE ; D-SACCHAROSE OCTABENZOATE ; BEET SUGAR BENZOATE
MDL号: MFCD00047542
氢键受体数量: 19
氢键供体数量: 0
Smile: c1ccc(cc1)C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O[C@]3([C@H]([C@@H]([C@H](O3)COC(=O)c4ccccc4)OC(=O)c5ccccc5)OC(=O)c6ccccc6)COC(=O)c7ccccc7)OC(=O)c8ccccc8)OC(=O)c9ccccc9)OC(=O)c1ccccc1
InChi: InChI=1S/C68H54O19/c69-59(44-25-9-1-10-26-44)77-41-52-54(81-62(72)47-31-15-4-16-32-47)56(83-64(74)49-35-19-6-20-36-49)57(84-65(75)50-37-21-7-22-38-50)67(80-52)87-68(43-79-61(71)46-29-13-3-14-30-46)58(85-66(76)51-39-23-8-24-40-51)55(82-63(73)48-33-17-5-18-34-48)53(86-68)42-78-60(70)45-27-11-2-12-28-45/h1-40,52-58,67H,41-43H2/t52-,53-,54-,55-,56+,57-,58+,67-,68+/m1/s1
InChiKey: InChIKey=AKIVKIDZMLQJCH-KWOGCLBWSA-N

性质

熔点: 93-100 DEG C(LIT)
物理性质: TRANSITION TEMPERATURE: SOFTENING POINT 98 DEG C (RING AND BALL)
注解: APPLICATION: PLASTICIZERHARDENING AGENT FOR COATINGS
OPTICAL ACTIVITY: [ALPHA]23/D +35 DEG, C = 1 IN CHLOROFORM
SOLUBILITY: AROMATICS, KETONES AND ESTERS: SOLUBLE
SOLUBILITY: WATER, ALCOHOLS AND ALIPHATICS: INSOLUBLE
UNSPSC: 12162002
WGK: 3

安全信息

WGK德国: 3

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