Home Other Building Blocks 2-Methyl-5-phenylthiophene

2-Methyl-5-phenylthiophene

CAS No.:
5069-26-1
Catalog Number:
AG003HNX
Molecular Formula:
C11H10S
Molecular Weight:
174.2621
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Product Description
Catalog Number:
AG003HNX
Chemical Name:
2-Methyl-5-phenylthiophene
CAS Number:
5069-26-1
Molecular Formula:
C11H10S
Molecular Weight:
174.2621
MDL Number:
MFCD06201035
IUPAC Name:
2-methyl-5-phenylthiophene
InChI:
InChI=1S/C11H10S/c1-9-7-8-11(12-9)10-5-3-2-4-6-10/h2-8H,1H3
InChI Key:
NEKXRPVOSZHILM-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)c1ccccc1
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.05g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.261g/mol
Monoisotopic Mass:
174.05g/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  
Literature
Title Journal
Excited-state dynamics and efficient triplet formation in phenylthiophene compounds. Physical chemistry chemical physics : PCCP 20120514
Properties