7-[[2-(乙酰氨基)-4-[(5-氯-2,6-二氟-4-嘧啶基)氨基]苯基]偶氮]萘-1,3-二磺酸二钠

CAS号
68155-62-4
CCD编号
CCD08273078
分子式
C22 H13 Cl F2 N6 O7 S2 . 2 Na
分子量
656.941

基本信息

产品名称: 7-[[2-(乙酰氨基)-4-[(5-氯-2,6-二氟-4-嘧啶基)氨基]苯基]偶氮]萘-1,3-二磺酸二钠
CAS: 68155-62-4
中文同义词: 7-[[2-(乙酰氨基)-4-[(5-氯-2,6-二氟-4-嘧啶基)氨基]苯基]偶氮]萘-1,3-二磺酸二钠
英文同义词: DISODIUM 7-[[2-(ACETYLAMINO)-4-[(5-CHLORO-2,6-DIFLUORO-4-PYRIMIDINYL)AMINO]PHENYL]AZO]NAPHTHALENE-1,3-DISULPHONATE ; DISODIUM 7-([2-ACETAMIDO-4-[(5-CHLORO-2,6-DIFLUORO-4-PYRIMIDINYL)AMINO]PHENYL]DIAZENYL)-1,3-NAPHTHALENEDISULFONATE
MDL号: MFCD23142807
氢键受体数量: 13
氢键供体数量: 2
Smile: CC(=O)Nc1cc(ccc1/N=N/c2ccc3cc(cc(c3c2)S(=O)(=O)[O-])S(=O)(=O)[O-])Nc4c(c(nc(n4)F)F)Cl.[Na+].[Na+]
InChi: InChI=1S/C22H15ClF2N6O7S2.2Na/c1-10(32)26-17-8-12(27-21-19(23)20(24)28-22(25)29-21)4-5-16(17)31-30-13-3-2-11-6-14(39(33,34)35)9-18(15(11)7-13)40(36,37)38;;/h2-9H,1H3,(H,26,32)(H,27,28,29)(H,33,34,35)(H,36,37,38);;/q;2*+1/p-2/b31-30+;;
InChiKey: InChIKey=PJFSGBWVNVLHPM-DGVXSHAUSA-L

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