C1CC(SC1)C2=CC=CC=C2N
CAS: 50461-36-4
名称: 2-(thiolan-2-yl)aniline
SMILES: C1CC(SC1)C2=CC=CC=C2N

Molecular Processing

Molecular formula
C10H13NS
Molecular weight
179.29
Exact mass
179.0769
XLogP
2.84
TPSA
26.02
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
55.29

Supplementary Information

InChIKey: BJHHEINMTYUQTA-UHFFFAOYSA-N
同義語
2-(thiolan-2-yl)aniline50461-36-42-(2-tetrahydrothienyl)anilineSCHEMBL11727830DTXSID10532448BJHHEINMTYUQTA-UHFFFAOYSA-N
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