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89188-73-8 | 2H-Pyrrole, 2,2-bis(phenylmethyl)-
CAS No: 89188-73-8 Catalog No: AG004TOP MDL No:
Product Description
Catalog Number:
AG004TOP
Chemical Name:
2H-Pyrrole, 2,2-bis(phenylmethyl)-
CAS Number:
89188-73-8
Molecular Formula:
C18H17N
Molecular Weight:
247.3343
IUPAC Name:
2,2-dibenzylpyrrole
InChI:
InChI=1S/C18H17N/c1-3-8-16(9-4-1)14-18(12-7-13-19-18)15-17-10-5-2-6-11-17/h1-13H,14-15H2
InChI Key:
PCMINTAIHOJCCL-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CC1(C=CC=N1)Cc1ccccc1
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.136g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.341g/mol
Monoisotopic Mass:
247.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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