Home Other Building Blocks 2-(propan-2-yloxy)ethanethioamide

2-(propan-2-yloxy)ethanethioamide

CAS No.:
1016885-92-9
Catalog Number:
AG01B3ZS
Molecular Formula:
C5H11NOS
Molecular Weight:
133.2119
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Product Description
Catalog Number:
AG01B3ZS
Chemical Name:
2-(propan-2-yloxy)ethanethioamide
CAS Number:
1016885-92-9
Molecular Formula:
C5H11NOS
Molecular Weight:
133.2119
MDL Number:
MFCD09938263
IUPAC Name:
2-propan-2-yloxyethanethioamide
InChI:
InChI=1S/C5H11NOS/c1-4(2)7-3-5(6)8/h4H,3H2,1-2H3,(H2,6,8)
InChI Key:
VJQOTQVSRGHYGW-UHFFFAOYSA-N
SMILES:
CC(OCC(=S)N)C
Properties
Complexity:
82.5  
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:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
133.209g/mol
Monoisotopic Mass:
133.056g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties