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825-55-8,MFCD00130080
Catalog No.:AA003HT7
825-55-8 | 2-Phenylthiophene
Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$52.00   $36.00
- +
10g
98%
in stock  
$86.00   $60.00
- +
25g
98%
in stock  
$172.00   $120.00
- +
100g
98%
in stock  
$556.00   $389.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA003HT7
Chemical Name:
2-Phenylthiophene
CAS Number:
825-55-8
Molecular Formula:
C10H8S
Molecular Weight:
160.2355
MDL Number:
MFCD00130080
IUPAC Name:
2-phenylthiophene
InChI:
InChI=1S/C10H8S/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8H
InChI Key:
PJRGDKFLFAYRBV-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1cccs1
Properties
Computed Properties
 
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.035g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.234g/mol
Monoisotopic Mass:
160.035g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

Synonyms
 
2-Phenylthiophene 
825-55-8 
2-phenyithiophene 
2-phenylthiofuran 
2- phenylthiophene 
ACMC-209ppe 
4'-Chlorophenylacetylene 
2-Phenylthiophene, 95% 
ChemDiv3_011280 
AC1Q7G2C 
SCHEMBL31124 
56842-14-9 
Thiophene, 2-phenyl- 
BIDD:GT0784 
AC1L2D52 
CTK3F0289 
PJRGDKFLFAYRBV-UHFFFAOYSA- 
2,2' :5'-2''-Terthiophene 
HMS1505A16 
CS-M2658 
KS-00000N7X 
ZINC1845652 
ANW-37584 
2-phenyl-thiophene 
BBL103864 
GEO-02140 
STL557674 
AKOS001111530 
DS-4996 
MCULE-6290897305 
RP22362 
TRA0068189 
VT20146 
IDI1_028838 
PJRGDKFLFAYRBV-UHFFFAOYSA-N 
AJ-31846 
AK117454 
AN-47714 
CJ-30110 
SY009364 
DB-056629 
TR-025800 
FT-0613350 
FT-0620765 
P1397 
MFCD00130080 
ST24041021 
Z2603 
MFCD00130080 (95%) 
825P558 
I09-3171 
W-200510 
InChI=1/C10H8S/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8H 
34565-50-9 
1-Chloro-4-ethynylbenzene 
C10H8S 
Thiophene, phenyl- 
C10-H-S 
C10-H8-S 
CID69999 
AR-1E5050 
ZINC01845652 
2-Phenylthiophene, 96% - 1G 1g 
ACN-035118 
A10396 
873-73-4 
Phenylthiophene 
Thiophene, 2-phenyl 
2-thienylbenzene 
Literature

Title: Mechanistic studies on the Pd-catalyzed direct C-H arylation of 2-substituted thiophene derivatives with arylpalladium bipyridyl complexes.

Journal: Chemistry, an Asian journal 20120601

Title: Excited-state dynamics and efficient triplet formation in phenylthiophene compounds.

Journal: Physical chemistry chemical physics : PCCP 20120514

Title: Preparation and acid-responsive photophysical properties of T-shaped π-conjugated molecules containing a benzimidazole junction.

Journal: Chemistry, an Asian journal 20111104

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: A computational study of photochemical isomerization reactions of thiophenes.

Journal: Journal of computational chemistry 20100115

Title: Inhibition of iNOS and COX-2 in human whole blood ex vivo and monocyte-macrophage J774 cells by a new group of aminothiopyrimidone derivatives.

Journal: Bioorganic & medicinal chemistry 20090301

Title: Phosphorescent platinum acetylide organogelators.

Journal: Journal of the American Chemical Society 20080227

Title: Structure-activity relationship development of dihaloaryl triazole compounds as insecticides and acaricides. 1. Phenyl thiophen-2-yl triazoles.

Journal: Journal of agricultural and food chemistry 20070905

Title: FTY720 story. Its discovery and the following accelerated development of sphingosine 1-phosphate receptor agonists as immunomodulators based on reverse pharmacology.

Journal: Perspectives in medicinal chemistry 20070101

Title: Phenylthiophene-dipicolinic acid-based emitters with strong solution blue and solid state green emission.

Journal: The journal of physical chemistry. B 20061228

Title: First evidence that cytochrome P450 may catalyze both S-oxidation and epoxidation of thiophene derivatives.

Journal: Biochemical and biophysical research communications 20051209

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

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