名称: 4-(6-hydroxy-hexyloxy)-benzoic acid
SMILES:
O=C(O)c1ccc(OCCCCCCO)cc1Molecular Processing
Molecular formula
C13H18O4
Molecular weight
238.28
Exact mass
238.1205
XLogP
2.32
TPSA
66.76
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
64.45
Supplementary Information
詳細情報を取得中…
17 件の反応に参加→