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838-40-4 | 1H-Pyrrole,2,5-diphenyl-
CAS No: 838-40-4 Catalog No: AG0054TK MDL No:MFCD00767151
Product Description
Catalog Number:
AG0054TK
Chemical Name:
1H-Pyrrole,2,5-diphenyl-
CAS Number:
838-40-4
Molecular Formula:
C16H13N
Molecular Weight:
219.2811
MDL Number:
MFCD00767151
IUPAC Name:
2,5-diphenyl-1H-pyrrole
InChI:
InChI=1S/C16H13N/c1-3-7-13(8-4-1)15-11-12-16(17-15)14-9-5-2-6-10-14/h1-12,17H
InChI Key:
RJCRXUOYULQDPG-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1ccc([nH]1)c1ccccc1
NSC Number:
56185
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.105g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.287g/mol
Monoisotopic Mass:
219.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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