CSCOC1=C(C=C(C=C1)Cl)Cl
Name: 2,4-dichloro-1-(methylsulfanylmethoxy)benzene
SMILES: CSCOC1=C(C=C(C=C1)Cl)Cl

Molecular Processing

Molecular formula
C8H8Cl2OS
Molecular weight
223.12
Exact mass
221.9673
XLogP
3.69
TPSA
9.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
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
0.25
Molar refractivity
55.47

Supplementary Information

InChIKey: YEVSWWMHMPTDJY-UHFFFAOYSA-N
Synonyme
SCHEMBL3275708YEVSWWMHMPTDJY-UHFFFAOYSA-N2,4-dichloro-1-methylsulfanylmethoxy-benzene
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