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155220-56-7 | 2H-Pyrrole, 3,4-dihydro-4,5-diphenyl-
CAS No: 155220-56-7 Catalog No: AG001NQ3 MDL No:
Product Description
Catalog Number:
AG001NQ3
Chemical Name:
2H-Pyrrole, 3,4-dihydro-4,5-diphenyl-
CAS Number:
155220-56-7
Molecular Formula:
C16H15N
Molecular Weight:
221.2970
IUPAC Name:
4,5-diphenyl-3,4-dihydro-2H-pyrrole
InChI:
InChI=1S/C16H15N/c1-3-7-13(8-4-1)15-11-12-17-16(15)14-9-5-2-6-10-14/h1-10,15H,11-12H2
InChI Key:
KUPQCZQPLKBESH-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1=NCCC1c1ccccc1
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.12g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.303g/mol
Monoisotopic Mass:
221.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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