甘氨酸邻甲酚红

CAS号
4079-10-1 ;77031-64-2
CCD编号
CCD00030251
分子式
C27 H25 N2 O9 S . 3 Na
分子量
622.536

基本信息

产品名称: 甘氨酸邻甲酚红
CAS: 4079-10-1 ;77031-64-2
中文同义词: 甘氨酸邻甲酚红
英文同义词: O-CRESOLSULFONPHTHALEIN-3',3''-BIS(METHYLAMINOACETIC ACID SODIUM SALT) ; GLYCINE CRESOL RED SODIUM SALT ; GLYCINE CRESOL RED
MDL号: MFCD00045545
氢键受体数量: 11
氢键供体数量: 3
Smile: Cc1cc(cc(c1O)CNCC(=O)[O-])/C(=C\2/C=C(C(=O)C(=C2)CNCC(=O)[O-])C)/c3ccccc3S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChi: InChI=1S/C27H28N2O9S.3Na/c1-15-7-17(9-19(26(15)34)11-28-13-23(30)31)25(21-5-3-4-6-22(21)39(36,37)38)18-8-16(2)27(35)20(10-18)12-29-14-24(32)33;;;/h3-10,28-29,34H,11-14H2,1-2H3,(H,30,31)(H,32,33)(H,36,37,38);;;/q;3*+1/p-3/b25-18+;;;
InChiKey: InChIKey=CFSBENFEKMMGSM-YWCDJFPNSA-K

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