86349-57-7 ((C.I. Pigment Yellow 12)

CAS号:
86349-57-7
英文名称:
C.I. Pigment Yellow 12
分子式:
C32H26Cl2N6O4
分子量:
629.492644786835

C.I. Pigment Yellow 12(86349-57-7)名称与标识符

名称

英文别名:
Butanamide,2,2'-[(3,3'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[3-oxo-N-phenyl-,labeled with carbon-14 (9CI);PIGMENT YELLOW 12;Benzidine Yellow;C.I. Pigment Yellow 12;Diarylanilide Yellow;Rangoon Yellow;Helioyellow GW;Benzidene Yellow;Light Yellow JB;Helic Yellow GW;Eljon Yellow BG;Light Yellow JBT;Light Yellow JBO;Helio Yellow GWN;Pigment Yellow GT;Benzidine Yellow E;Kromon Yellow MTB;Monolite Yellow GT;Irgalite Yellow BO;Carnelio Yellow GX;Recolite Yellow BG;Siloton Yellow GTX;Benzidine Yellow GF;Benzidine Yellow GT;Benzidine Yellow HG;Recolite Yellow BGT;Monolite Yellow GTA;Monolite Yellow;

标识符

InChIKey:
GNCOVOVCHIHPHP-HVMBLDELSA-N
Inchi:
1S/C32H26Cl2N6O4/c1-19(41)29(31(43)35-23-9-5-3-6-10-23)39-37-27-15-13-21(17-25(27)33)22-14-16-28(26(34)18-22)38-40-30(20(2)42)32(44)36-24-11-7-4-8-12-24/h3-18,29-30H,1-2H3,(H,35,43)(H,36,44)/b39-37+,40-38+
SMILES:
ClC1=C(C=CC(=C1)C1C=CC(=C(C=1)Cl)/N=N/C(C(C)=O)C(NC1C=CC=CC=1)=O)/N=N/C(C(C)=O)C(NC1C=CC=CC=1)=O

C.I. Pigment Yellow 12(86349-57-7)物化性质

计算特性

  • 氢键供体数量 : 2
  • 氢键受体数量 : 8
  • 可旋转化学键数量 : 11
  • 重原子数量 : 44
  • 复杂度 : 979
  • 拓扑分子极性表面积 : 142

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