C1=CC=C(C=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=CC=C3)C(=O)O
CAS: 10109-95-2
Название: 2,5-dianilinoterephthalic acid
SMILES: C1=CC=C(C=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=CC=C3)C(=O)O

Molecular Processing

Molecular formula
C20H16N2O4
Molecular weight
348.36
Exact mass
348.111
XLogP
4.57
TPSA
98.66
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
99.81

Supplementary Information

InChIKey: ZJQZWNLKRBUEKX-UHFFFAOYSA-N
Синонимы
2,5-Dianilinoterephthalic acid1,4-Benzenedicarboxylic acid, 2,5-bis(phenylamino)-EINECS 233-302-8DTXSID7064948EC 233-302-8RefChem:82758DTXCID5032600233-302-810109-95-22,5-bis(phenylamino)terephthalic acid2,5-di(phenylamino)terephthalic acidCBDivE_010595MFCD00044044H2QSS4HZP2Oprea1_567229Oprea1_5948542,5dianilinoterephthalic acidSCHEMBL3517052,5 -dianilinoterephthalic acid2,5-dianilino-terephthalic acid2,5-diphenylaminoterephthalic acid2,5-di(phenylamino) terephthalic acidBS-515942,5-Dianilinobenzene-1,4-dicarboxylic acidCS-0170343NS00002789E77862F6911532,5-Bis(phenylamino)-1,4-benzenedicarboxylic acid
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