Home Other Building Blocks 3-(5-methylthiophen-3-yl)pyrrolidine

3-(5-methylthiophen-3-yl)pyrrolidine

CAS No.:
1260842-14-5
Catalog Number:
AG01AFH0
Molecular Formula:
C9H13NS
Molecular Weight:
167.2712
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Product Description
Catalog Number:
AG01AFH0
Chemical Name:
3-(5-methylthiophen-3-yl)pyrrolidine
CAS Number:
1260842-14-5
Molecular Formula:
C9H13NS
Molecular Weight:
167.2712
MDL Number:
MFCD17484117
IUPAC Name:
3-(5-methylthiophen-3-yl)pyrrolidine
InChI:
InChI=1S/C9H13NS/c1-7-4-9(6-11-7)8-2-3-10-5-8/h4,6,8,10H,2-3,5H2,1H3
InChI Key:
SGJNNRKQCVSHNB-UHFFFAOYSA-N
SMILES:
Cc1scc(c1)C1CNCC1
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.077g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.27g/mol
Monoisotopic Mass:
167.077g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties