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Details

Stereochemistry ACHIRAL
Molecular Formula C10H9N
Molecular Weight 143.1852
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-PHENYLPYRROLE

SMILES

C1=CN(C=C1)C2=CC=CC=C2

InChI

InChIKey=GEZGAZKEOUKLBR-UHFFFAOYSA-N
InChI=1S/C10H9N/c1-2-6-10(7-3-1)11-8-4-5-9-11/h1-9H

HIDE SMILES / InChI

Molecular Formula C10H9N
Molecular Weight 143.1852
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Singlet excited state dipole moments of dual fluorescent N-phenylpyrroles and 4-(dimethylamino)benzonitrile from solvatochromic and thermochromic spectral shifts.
2003 Mar
Fast intramolecular charge transfer with a planar rigidized electron donor/acceptor molecule.
2004 Jul 14
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.
2005 Feb 3
Kinetics of intramolecular charge transfer with N-phenylpyrrole in alkyl cyanides.
2005 Mar 3
Computational characterization of low-lying states and intramolecular charge transfers in N-phenylpyrrole and the planar-rigidized fluorazene.
2006 Feb 9
Intramolecular charge transfer and dielectric solvent relaxation in n-propyl cyanide. N-phenylpyrrole and 4-dimethylamino-4'-cyanostilbene.
2006 Nov 30
Synthesis and biological activity of 2-alkylbenzimidazoles bearing a N-phenylpyrrole moiety as novel angiotensin II AT1 receptor antagonists.
2007 May 15
Computation of through-space NMR shielding effects in aromatic ring pi-stacked complexes.
2008 Apr
Intramolecular charge transfer with the planarized 4-cyanofluorazene and its flexible counterpart 4-cyano-N-phenylpyrrole. Picosecond fluorescence decays and femtosecond excited-state absorption.
2008 Sep 11
Experimental charge density studies of disordered N-phenylpyrrole and N-(4-fluorophenyl)pyrrole.
2009 Sep 3
Pentacyano-N,N-dimethylaniline in the excited state. Only locally excited state emission, in spite of the large electron affinity of the pentacyanobenzene subgroup.
2010 Dec 23
Intramolecular charge transfer with fluorazene and N-phenylpyrrole.
2010 Feb 4
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.
2010 Mar 13
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:34:01 GMT 2023
Edited
by admin
on Fri Dec 15 19:34:01 GMT 2023
Record UNII
3OD6N6545H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-PHENYLPYRROLE
Systematic Name English
N-PHENYLPYRROLE
Systematic Name English
NSC-16581
Code English
Code System Code Type Description
CAS
635-90-5
Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023
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NSC
16581
Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023
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ECHA (EC/EINECS)
211-242-3
Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023
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EPA CompTox
DTXSID60212905
Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023
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FDA UNII
3OD6N6545H
Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023
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PUBCHEM
12480
Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023
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MESH
C517402
Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023
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