Home Other Building Blocks 4-Bromo-2-methyl-1,1'-biphenyl

4-Bromo-2-methyl-1,1'-biphenyl

CAS No.:
5002-26-6
Catalog Number:
AG003KX8
Molecular Formula:
C13H11Br
Molecular Weight:
247.1304
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Product Description
Catalog Number:
AG003KX8
Chemical Name:
4-Bromo-2-methyl-1,1'-biphenyl
CAS Number:
5002-26-6
Molecular Formula:
C13H11Br
Molecular Weight:
247.1304
MDL Number:
MFCD03093069
IUPAC Name:
4-bromo-2-methyl-1-phenylbenzene
InChI:
InChI=1S/C13H11Br/c1-10-9-12(14)7-8-13(10)11-5-3-2-4-6-11/h2-9H,1H3
InChI Key:
ZBNARPVMXYNXQQ-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)C)c1ccccc1
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.004g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.135g/mol
Monoisotopic Mass:
246.004g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties