General
Preferred name
PD157941
Synonyms
2-Hexylthiophene ()
P&D ID
PD157941
CAS
18794-77-9
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION 2-Hexylthiophene is an extremely weak basic heteroaromatic compound. 2-Hexylthiophene can be used to modify and improve the molar absorption coefficient of ruthenium sensitizer[1]
PRICE 29
DESCRIPTION 2-Hexylthiophene, a weakly basic heteroaromatic compound, can enhance the molar absorption coefficient of ruthenium sensitizers by undergoing modification.
Compound Sets
2
MedChem Express Bioactive Compound Library
HY-34544
Selleckchem Bioactive Compound Library
2-hexylthiophene
External IDs
18
Properties
(calculated by RDKit )
Molecular Weight
168.1
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
0
Rotatable Bonds
5
Ring Count
1
Aromatic Ring Count
1
cLogP
3.87
TPSA
0.0
Fraction CSP3
0.6
Chiral centers
0.0
Largest ring
5.0
QED
0.59
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data