Home Other Building Blocks octahydrocyclopenta[b]thiomorpholine

octahydrocyclopenta[b]thiomorpholine

CAS No.:
30196-20-4
Catalog Number:
AG01B1CA
Molecular Formula:
C7H13NS
Molecular Weight:
143.2498
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Product Description
Catalog Number:
AG01B1CA
Chemical Name:
octahydrocyclopenta[b]thiomorpholine
CAS Number:
30196-20-4
Molecular Formula:
C7H13NS
Molecular Weight:
143.2498
MDL Number:
MFCD19159789
IUPAC Name:
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b][1,4]thiazine
InChI:
InChI=1S/C7H13NS/c1-2-6-7(3-1)9-5-4-8-6/h6-8H,1-5H2
InChI Key:
IJJUBIFQLYZYPO-UHFFFAOYSA-N
SMILES:
C1CSC2C(N1)CCC2
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.077g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
143.248g/mol
Monoisotopic Mass:
143.077g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties