CC=C(C(=O)O)c1ccccc1COC
名称: α-(2-methoxymethylphenyl)-β-methylacrylic acid
SMILES: CC=C(C(=O)O)c1ccccc1COC

Molecular Processing

Molecular formula
C12H14O3
Molecular weight
206.24
Exact mass
206.0943
XLogP
2.32
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
58.44

Supplementary Information

詳細情報を取得中…

2 件の反応に参加