CSC1=CC=C(C=C1)C2=C(CCC2)Br
이름: 1-(2-bromocyclopenten-1-yl)-4-methylsulfanylbenzene
SMILES: CSC1=CC=C(C=C1)C2=C(CCC2)Br

Molecular Processing

Molecular formula
C12H13BrS
Molecular weight
269.21
Exact mass
267.9921
XLogP
4.7
TPSA
0
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
67.92

Supplementary Information

InChIKey: GYDGTIWKUWUOIJ-UHFFFAOYSA-N
동의어
SCHEMBL8652478GYDGTIWKUWUOIJ-UHFFFAOYSA-N1-(2-bromocyclopenten-1-yl)-4-(methylthio)benzene
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