Home Other Building Blocks 4-ethyl-N-[(5-methylthiophen-2-yl)methyl]aniline

4-ethyl-N-[(5-methylthiophen-2-yl)methyl]aniline

CAS No.:
869947-61-5
Catalog Number:
AG019MQO
Molecular Formula:
C14H17NS
Molecular Weight:
231.3565
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Product Description
Catalog Number:
AG019MQO
Chemical Name:
4-ethyl-N-[(5-methylthiophen-2-yl)methyl]aniline
CAS Number:
869947-61-5
Molecular Formula:
C14H17NS
Molecular Weight:
231.3565
MDL Number:
MFCD04550285
IUPAC Name:
4-ethyl-N-[(5-methylthiophen-2-yl)methyl]aniline
InChI:
InChI=1S/C14H17NS/c1-3-12-5-7-13(8-6-12)15-10-14-9-4-11(2)16-14/h4-9,15H,3,10H2,1-2H3
InChI Key:
LVGFANAILVSSMV-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)NCc1ccc(s1)C
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.108g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.357g/mol
Monoisotopic Mass:
231.108g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties