Home Other Building Blocks 2-(trifluoromethyl)thiomorpholine

2-(trifluoromethyl)thiomorpholine

CAS No.:
1446485-41-1
Catalog Number:
AG01BJ30
Molecular Formula:
C5H8F3NS
Molecular Weight:
171.1839
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Product Description
Catalog Number:
AG01BJ30
Chemical Name:
2-(trifluoromethyl)thiomorpholine
CAS Number:
1446485-41-1
Molecular Formula:
C5H8F3NS
Molecular Weight:
171.1839
MDL Number:
MFCD28361693
IUPAC Name:
2-(trifluoromethyl)thiomorpholine
InChI:
InChI=1S/C5H8F3NS/c6-5(7,8)4-3-9-1-2-10-4/h4,9H,1-3H2
InChI Key:
VDMYKWRTPIJCPI-UHFFFAOYSA-N
SMILES:
FC(C1SCCNC1)(F)F
Properties
Complexity:
114  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.033g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.181g/mol
Monoisotopic Mass:
171.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties