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1823403-07-1

1823403-07-1 | 3-Bromo-6-iodo-2-methylanisole

CAS No: 1823403-07-1 Catalog No: AG01FF3D MDL No:MFCD28291785

Product Description

Catalog Number:
AG01FF3D
Chemical Name:
3-Bromo-6-iodo-2-methylanisole
CAS Number:
1823403-07-1
Molecular Formula:
C8H8BrIO
Molecular Weight:
326.9570
MDL Number:
MFCD28291785
IUPAC Name:
1-bromo-4-iodo-3-methoxy-2-methylbenzene
InChI:
InChI=1S/C8H8BrIO/c1-5-6(9)3-4-7(10)8(5)11-2/h3-4H,1-2H3
InChI Key:
CBMISVGFEJJDHV-UHFFFAOYSA-N
SMILES:
COc1c(I)ccc(c1C)Br

Properties

Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.88g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.959g/mol
Monoisotopic Mass:
325.88g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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