Home Other Building Blocks [2-(ethylsulfanyl)pyridin-4-yl]methanamine

[2-(ethylsulfanyl)pyridin-4-yl]methanamine

CAS No.:
1157038-68-0
Catalog Number:
AG01AFV9
Molecular Formula:
C8H12N2S
Molecular Weight:
168.2593
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Product Description
Catalog Number:
AG01AFV9
Chemical Name:
[2-(ethylsulfanyl)pyridin-4-yl]methanamine
CAS Number:
1157038-68-0
Molecular Formula:
C8H12N2S
Molecular Weight:
168.2593
MDL Number:
MFCD12191883
IUPAC Name:
(2-ethylsulfanylpyridin-4-yl)methanamine
InChI:
InChI=1S/C8H12N2S/c1-2-11-8-5-7(6-9)3-4-10-8/h3-5H,2,6,9H2,1H3
InChI Key:
ULNSWZJRJPRPPE-UHFFFAOYSA-N
SMILES:
CCSc1nccc(c1)CN
Properties
Complexity:
108  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.072g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.258g/mol
Monoisotopic Mass:
168.072g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties