Home Other Building Blocks thiomorpholin-3-ylmethanamine

thiomorpholin-3-ylmethanamine

CAS No.:
103742-33-2
Catalog Number:
AG01A47U
Molecular Formula:
C5H12N2S
Molecular Weight:
132.2272
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Product Description
Catalog Number:
AG01A47U
Chemical Name:
thiomorpholin-3-ylmethanamine
CAS Number:
103742-33-2
Molecular Formula:
C5H12N2S
Molecular Weight:
132.2272
MDL Number:
MFCD19207011
IUPAC Name:
thiomorpholin-3-ylmethanamine
InChI:
InChI=1S/C5H12N2S/c6-3-5-4-8-2-1-7-5/h5,7H,1-4,6H2
InChI Key:
XQQOTDHTMBHKRA-UHFFFAOYSA-N
SMILES:
NCC1CSCCN1
Properties
Complexity:
67.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.072g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
132.225g/mol
Monoisotopic Mass:
132.072g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties