C=C(CC#CC(C)(C)O)CC#CC(C)(C)O
SMILES: C=C(CC#CC(C)(C)O)CC#CC(C)(C)O

Molecular Processing

Molecular formula
C14H20O2
Molecular weight
220.31
Exact mass
220.1463
XLogP
1.87
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
16
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
66.52

Supplementary Information

詳細情報を取得中…

1 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→