CC(C)NCCSC1=CC=C(C=C1)Cl.Cl
이름: N-[2-(4-chlorophenyl)sulfanylethyl]propan-2-amine;hydrochloride
SMILES: CC(C)NCCSC1=CC=C(C=C1)Cl.Cl

Molecular Processing

Molecular formula
C11H17Cl2NS
Molecular weight
266.24
Exact mass
265.0459
XLogP
3.85
TPSA
12.03
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.455
Molar refractivity
72.56

Supplementary Information

InChIKey: VFXPNEXEMZNMNY-UHFFFAOYSA-N
동의어
SCHEMBL10689510VFXPNEXEMZNMNY-UHFFFAOYSA-NN-[2-[(4-Chlorophenyl)thio]ethyl]-1-methylethanamine hydrochloride
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