Home Nitriles 5-Phenyl-1H-pyrrole-3-carbonitrile

5-Phenyl-1H-pyrrole-3-carbonitrile

CAS No.:
122453-85-4
Catalog Number:
AG01DD79
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01DD79
Chemical Name:
5-Phenyl-1H-pyrrole-3-carbonitrile
CAS Number:
122453-85-4
MDL Number:
MFCD20662717
IUPAC Name:
5-phenyl-1H-pyrrole-3-carbonitrile
InChI:
InChI=1S/C11H8N2/c12-7-9-6-11(13-8-9)10-4-2-1-3-5-10/h1-6,8,13H
InChI Key:
QHCBCVFLFCKZJA-UHFFFAOYSA-N
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.069g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.199g/mol
Monoisotopic Mass:
168.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties