名称: 3-Bromo-7-methyl-phenanthrene-9-carboxylic acid
SMILES:
Cc1ccc2c(c1)c(C(=O)O)cc1ccc(Br)cc12Molecular Processing
Molecular formula
C16H11BrO2
Molecular weight
315.17
Exact mass
313.9942
XLogP
4.76
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
80.85
Supplementary Information
詳細情報を取得中…
5 件の反応に参加→