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119198-74-2

119198-74-2 | 5H-Thieno[2,3-c]pyrrole, 5-(phenylmethyl)-

CAS No: 119198-74-2 Catalog No: AG000IBR MDL No:

Product Description

Catalog Number:
AG000IBR
Chemical Name:
5H-Thieno[2,3-c]pyrrole, 5-(phenylmethyl)-
CAS Number:
119198-74-2
Molecular Formula:
C13H11NS
Molecular Weight:
213.2981
IUPAC Name:
5-benzylthieno[2,3-c]pyrrole
InChI:
InChI=1S/C13H11NS/c1-2-4-11(5-3-1)8-14-9-12-6-7-15-13(12)10-14/h1-7,9-10H,8H2
InChI Key:
IRFINWQEEMIRIK-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Cn1cc2c(c1)ccs2

Properties

Complexity:
213  
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:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.298g/mol
Monoisotopic Mass:
213.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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