الاسم: 2′-cyano-5-(ethoxycarbonyl)-4′-methylbiphenyl-3-carboxylic acid
SMILES:
CCOC(=O)c1cc(C(=O)O)cc(-c2ccc(C)cc2C#N)c1Molecular Processing
Molecular formula
C18H15NO4
Molecular weight
309.32
Exact mass
309.1001
XLogP
3.41
TPSA
87.39
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
84.25
Supplementary Information
جارٍ جلب التفاصيل…
مشارك في 2 تفاعل→