Home Other Building Blocks 3-ethynyl-N-(thiophen-2-ylmethyl)aniline

3-ethynyl-N-(thiophen-2-ylmethyl)aniline

CAS No.:
1019586-19-6
Catalog Number:
AG01AAE5
Molecular Formula:
C13H11NS
Molecular Weight:
213.2981
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AAE5
Chemical Name:
3-ethynyl-N-(thiophen-2-ylmethyl)aniline
CAS Number:
1019586-19-6
Molecular Formula:
C13H11NS
Molecular Weight:
213.2981
MDL Number:
MFCD11138203
IUPAC Name:
3-ethynyl-N-(thiophen-2-ylmethyl)aniline
InChI:
InChI=1S/C13H11NS/c1-2-11-5-3-6-12(9-11)14-10-13-7-4-8-15-13/h1,3-9,14H,10H2
InChI Key:
ODIYJJXDOWTSEO-UHFFFAOYSA-N
SMILES:
C#Cc1cccc(c1)NCc1cccs1
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.061g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.298g/mol
Monoisotopic Mass:
213.061g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties