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147792-45-8

147792-45-8 | Dibenzothiophene, 3-propyl-

CAS No: 147792-45-8 Catalog No: AG001F84 MDL No:

Product Description

Catalog Number:
AG001F84
Chemical Name:
Dibenzothiophene, 3-propyl-
CAS Number:
147792-45-8
Molecular Formula:
C15H14S
Molecular Weight:
226.3367
IUPAC Name:
3-propyldibenzothiophene
InChI:
InChI=1S/C15H14S/c1-2-5-11-8-9-13-12-6-3-4-7-14(12)16-15(13)10-11/h3-4,6-10H,2,5H2,1H3
InChI Key:
QQTNEMOSIHBPRT-UHFFFAOYSA-N
SMILES:
CCCc1ccc2c(c1)sc1c2cccc1

Properties

Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.082g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.337g/mol
Monoisotopic Mass:
226.082g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7  

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