Home Other Building Blocks 1-Phenylpyrrole

1-Phenylpyrrole

CAS No.:
635-90-5
Catalog Number:
AG003ELR
Molecular Formula:
C10H9N
Molecular Weight:
143.1852
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$50
- +
25g
95%
In Stock USA
United States
$200
- +
Product Description
Catalog Number:
AG003ELR
Chemical Name:
1-Phenylpyrrole
CAS Number:
635-90-5
Molecular Formula:
C10H9N
Molecular Weight:
143.1852
MDL Number:
MFCD00005343
IUPAC Name:
1-phenylpyrrole
InChI:
InChI=1S/C10H9N/c1-2-6-10(7-3-1)11-8-4-5-9-11/h1-9H
InChI Key:
GEZGAZKEOUKLBR-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)n1cccc1
EC Number:
211-242-3
UNII:
3OD6N6545H
NSC Number:
16581
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.073g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.189g/mol
Monoisotopic Mass:
143.073g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
Synthesis of atropisomeric 1-phenylpyrrole-derived amino alcohols: new chiral ligands. Chirality 20120701
Enantioselectivity in organocatalytic cascade double Michael addition reaction: a theoretical study. The journal of physical chemistry. A 20120112
Pentacyano-N,N-dimethylaniline in the excited state. Only locally excited state emission, in spite of the large electron affinity of the pentacyanobenzene subgroup. The journal of physical chemistry. A 20101223
12-(4-Methoxy-phen-yl)-10-phenyl-3,4,5,6,8,10-hexa-azatricyclo-[7.3.0.0]dodeca-1(9),2,4,7,11-penta-ene. Acta crystallographica. Section E, Structure reports online 20100401
Intramolecular charge transfer with fluorazene and N-phenylpyrrole. The journal of physical chemistry. A 20100204
Platinum-catalyzed multi-step reaction of propargyl alcohols with N-heteroaromatics. Chemistry, an Asian journal 20100104
Experimental charge density studies of disordered N-phenylpyrrole and N-(4-fluorophenyl)pyrrole. The journal of physical chemistry. A 20090903
Intramolecular charge transfer with 4-fluorofluorazene and the flexible 4-fluoro-N-phenylpyrrole. The journal of physical chemistry. A 20090820
Intramolecular charge transfer with the planarized 4-cyanofluorazene and its flexible counterpart 4-cyano-N-phenylpyrrole. Picosecond fluorescence decays and femtosecond excited-state absorption. The journal of physical chemistry. A 20080911
Computation of through-space NMR shielding effects in aromatic ring pi-stacked complexes. Journal of molecular graphics & modelling 20080401
Synthesis and biological activity of 2-alkylbenzimidazoles bearing a N-phenylpyrrole moiety as novel angiotensin II AT1 receptor antagonists. Bioorganic & medicinal chemistry letters 20070515
Ligand-activated lithium-mediated zincation of N-phenylpyrrole. Chemistry (Weinheim an der Bergstrasse, Germany) 20070101
Intramolecular charge transfer and dielectric solvent relaxation in n-propyl cyanide. N-phenylpyrrole and 4-dimethylamino-4'-cyanostilbene. The journal of physical chemistry. A 20061130
Computational characterization of low-lying states and intramolecular charge transfers in N-phenylpyrrole and the planar-rigidized fluorazene. The journal of physical chemistry. A 20060209
TICT formation in para- and meta-derivatives of N-phenylpyrrole. The journal of physical chemistry. A 20060112
Kinetics of intramolecular charge transfer with N-phenylpyrrole in alkyl cyanides. The journal of physical chemistry. A 20050303
Charge-transfer-type fluorescence of 4-(1H-pyrrol-1-yl)benzonitrile (PBN) and N-phenylpyrrole (PP) in cryogenic matrixes: evidence for direct excitation of the CT band. The journal of physical chemistry. A 20050203
Fast intramolecular charge transfer with a planar rigidized electron donor/acceptor molecule. Journal of the American Chemical Society 20040714
Singlet excited state dipole moments of dual fluorescent N-phenylpyrroles and 4-(dimethylamino)benzonitrile from solvatochromic and thermochromic spectral shifts. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20030301
Properties