CCCCCCCCCCCCC1=CC(=O)c2c(Cl)cccc2C1=O
Название: 5-chloro-2-dodecyl-1,4-naphthoquinone
SMILES: CCCCCCCCCCCCC1=CC(=O)c2c(Cl)cccc2C1=O

Molecular Processing

Molecular formula
C22H29ClO2
Molecular weight
360.93
Exact mass
360.1856
XLogP
6.96
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
11
Heavy atoms
25
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.545
Molar refractivity
104.66

Supplementary Information

Загрузка подробностей…

Участвует в 7 реакциях