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1443305-65-4 | 3-Bromo-2'-methylthiobiphenyl
CAS No: 1443305-65-4 Catalog No: AG01FF6K MDL No:
Product Description
Catalog Number:
AG01FF6K
Chemical Name:
3-Bromo-2'-methylthiobiphenyl
CAS Number:
1443305-65-4
Molecular Formula:
C13H11BrS
Molecular Weight:
279.1954
IUPAC Name:
1-bromo-3-(2-methylsulfanylphenyl)benzene
InChI:
InChI=1S/C13H11BrS/c1-15-13-8-3-2-7-12(13)10-5-4-6-11(14)9-10/h2-9H,1H3
InChI Key:
RAYIIQPMABLNJN-UHFFFAOYSA-N
SMILES:
CSc1ccccc1c1cccc(c1)Br
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.976g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.195g/mol
Monoisotopic Mass:
277.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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