Home Other Building Blocks 3-(5-methylfuran-2-yl)thiomorpholine

3-(5-methylfuran-2-yl)thiomorpholine

CAS No.:
1344306-84-8
Catalog Number:
AG019SK5
Molecular Formula:
C9H13NOS
Molecular Weight:
183.2706
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Product Description
Catalog Number:
AG019SK5
Chemical Name:
3-(5-methylfuran-2-yl)thiomorpholine
CAS Number:
1344306-84-8
Molecular Formula:
C9H13NOS
Molecular Weight:
183.2706
MDL Number:
MFCD20287203
IUPAC Name:
3-(5-methylfuran-2-yl)thiomorpholine
InChI:
InChI=1S/C9H13NOS/c1-7-2-3-9(11-7)8-6-12-5-4-10-8/h2-3,8,10H,4-6H2,1H3
InChI Key:
VGIHRALKSXBBGQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(o1)C1CSCCN1
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.072g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.269g/mol
Monoisotopic Mass:
183.072g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties