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198027-67-7 | 1H-Pyrrole, 3-bromo-4-(2-bromoethyl)-1,2,5-triphenyl-
CAS No: 198027-67-7 Catalog No: AG002B8M MDL No:
Product Description
Catalog Number:
AG002B8M
Chemical Name:
1H-Pyrrole, 3-bromo-4-(2-bromoethyl)-1,2,5-triphenyl-
CAS Number:
198027-67-7
Molecular Formula:
C24H19Br2N
Molecular Weight:
481.2224
IUPAC Name:
3-bromo-4-(2-bromoethyl)-1,2,5-triphenylpyrrole
InChI:
InChI=1S/C24H19Br2N/c25-17-16-21-22(26)24(19-12-6-2-7-13-19)27(20-14-8-3-9-15-20)23(21)18-10-4-1-5-11-18/h1-15H,16-17H2
InChI Key:
WIKBXSQPOOJQEO-UHFFFAOYSA-N
SMILES:
BrCCc1c(Br)c(n(c1c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
480.986g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
481.231g/mol
Monoisotopic Mass:
478.988g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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