이름: Methyl 7-hydroxy-8-methyl-2-(trifluoromethyl)-2H-chromene-3-carboxylate
SMILES:
COC(=O)C1=Cc2ccc(O)c(C)c2OC1C(F)(F)FMolecular Processing
Molecular formula
C13H11F3O4
Molecular weight
288.22
Exact mass
288.0609
XLogP
2.58
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
63.31
Supplementary Information
상세 정보 불러오는 중…
3개 반응에 참여→