Home Other Building Blocks 3-(piperidin-1-yl)propanethioamide

3-(piperidin-1-yl)propanethioamide

CAS No.:
16888-42-9
Catalog Number:
AG019MW5
Molecular Formula:
C8H16N2S
Molecular Weight:
172.2910
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Product Description
Catalog Number:
AG019MW5
Chemical Name:
3-(piperidin-1-yl)propanethioamide
CAS Number:
16888-42-9
Molecular Formula:
C8H16N2S
Molecular Weight:
172.2910
MDL Number:
MFCD08558316
IUPAC Name:
3-piperidin-1-ylpropanethioamide
InChI:
InChI=1S/C8H16N2S/c9-8(11)4-7-10-5-2-1-3-6-10/h1-7H2,(H2,9,11)
InChI Key:
JJGDQVVOQMYENJ-UHFFFAOYSA-N
SMILES:
NC(=S)CCN1CCCCC1
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.103g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.29g/mol
Monoisotopic Mass:
172.103g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties