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1551-27-5,MFCD00014533
Catalog No.:AA003HU4
1551-27-5 | 2-n-Propylthiophene
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5g
>98.0%(GC)
1 week  
$55.00   $39.00
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  • Technical Information
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Technical Information
Catalog Number:
AA003HU4
Chemical Name:
2-n-Propylthiophene
CAS Number:
1551-27-5
Molecular Formula:
C7H10S
Molecular Weight:
126.2193
MDL Number:
MFCD00014533
IUPAC Name:
2-propylthiophene
InChI:
InChI=1S/C7H10S/c1-2-4-7-5-3-6-8-7/h3,5-6H,2,4H2,1H3
InChI Key:
BTXIJTYYMLCUHI-UHFFFAOYSA-N
SMILES:
CCCc1cccs1
EC Number:
216-288-8
UNII:
Y6M897104J
NSC Number:
82326
Properties
Computed Properties
 
Complexity:
61.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.05g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.217g/mol
Monoisotopic Mass:
126.05g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

Synonyms
 
2-Propylthiophene 
1551-27-5 
2-propyl-thiophene 
2-Propyl thiophene 
NSC82326 
Thiophene, propyl- 
EINECS 216-288-8 
AC1L2KHA 
AC1Q7FUM 
2-Propylthiophene, 97% 
4-Hydroxy-benzenesulfonamide 
BIDD:GT0385 
2-n-Propylthiophene 
SCHEMBL151464 
Jsp003034 
DTXSID50165810 
ZINC1631214 
NSC-82326 
SBB073407 
AKOS005169226 
MCULE-8817558072 
AJ-28449 
AS-11284 
Isopropylthiophene 
CJ-26265 
DB-064070 
ST2417172 
A3467 
FT-0613238 
P2451 
ST51061578 
M-3489 
J-640138 
J-800142 
THIOPHENE, 2-PROPYL- 
W-108023 
I14-60799 
C7H10S 
Benzenesulfonamide,4-hydroxy- 
C7-H10-S 
CID73771 
AR-1E5239 
1-Phenyl-4,5-dichloro-6-pyridazine 
2-n-Propylthiophene, 97% - 1G 1g 
1576-43-8 
UNII-Y6M897104J 
2-n-PROPYL THIOPHENE 
BTXIJTYYMLCUHI-UHFFFAOYSA-N 
MFCD00014533 
Y6M897104J 
Literature

Title: [Determination and distribution of sulfur compounds in coked gasoline by gas chromatography-sulfur chemiluminescence detection].

Journal: Se pu = Chinese journal of chromatography 20070501

Title: A computational investigation of the different intermediates during organoalkoxysilane hydrolysis.

Journal: The journal of physical chemistry. B 20061207

Title: A rational approach in the design of selective mesoporous adsorbents.

Journal: Langmuir : the ACS journal of surfaces and colloids 20061107

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

Journal: Chemical research in toxicology 20050601

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