Home Other Building Blocks thiomorpholin-3-ylmethanol

thiomorpholin-3-ylmethanol

CAS No.:
58729-32-1
Catalog Number:
AG01A3KT
Molecular Formula:
C5H11NOS
Molecular Weight:
133.2119
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Product Description
Catalog Number:
AG01A3KT
Chemical Name:
thiomorpholin-3-ylmethanol
CAS Number:
58729-32-1
Molecular Formula:
C5H11NOS
Molecular Weight:
133.2119
MDL Number:
MFCD02666403
IUPAC Name:
thiomorpholin-3-ylmethanol
InChI:
InChI=1S/C5H11NOS/c7-3-5-4-8-2-1-6-5/h5-7H,1-4H2
InChI Key:
MXFNPNPWOIRFCE-UHFFFAOYSA-N
SMILES:
OCC1CSCCN1
Properties
Complexity:
69.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.056g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
133.209g/mol
Monoisotopic Mass:
133.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties