الاسم: 2-bromo-4-(methylsulfanylmethyl)aniline
SMILES:
CSCC1=CC(=C(C=C1)N)BrMolecular Processing
Molecular formula
C8H10BrNS
Molecular weight
232.15
Exact mass
230.9717
XLogP
2.89
TPSA
26.02
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
11
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
55.77
Supplementary Information
InChIKey: KJSVWELGVJOSKP-UHFFFAOYSA-N
مرادفات
SCHEMBL7444031KJSVWELGVJOSKP-UHFFFAOYSA-N2-bromo-4-(methylthiomethyl)aniline
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