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1443313-46-9

1443313-46-9 | 3-Bromo-3'-(methylthio)biphenyl

CAS No: 1443313-46-9 Catalog No: AG01FEWW MDL No:

Product Description

Catalog Number:
AG01FEWW
Chemical Name:
3-Bromo-3'-(methylthio)biphenyl
CAS Number:
1443313-46-9
Molecular Formula:
C13H11BrS
Molecular Weight:
279.1954
IUPAC Name:
1-bromo-3-(3-methylsulfanylphenyl)benzene
InChI:
InChI=1S/C13H11BrS/c1-15-13-7-3-5-11(9-13)10-4-2-6-12(14)8-10/h2-9H,1H3
InChI Key:
DGURKULXXPJOCV-UHFFFAOYSA-N
SMILES:
CSc1cccc(c1)c1cccc(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:
4.8  

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