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6627-51-6 | 1-Bromo-2-chloro-4-methylbenzene
CAS No: 6627-51-6 Catalog No: AG003KY1 MDL No:MFCD00045161
Product Description
Catalog Number:
AG003KY1
Chemical Name:
1-Bromo-2-chloro-4-methylbenzene
CAS Number:
6627-51-6
Molecular Formula:
C7H6BrCl
Molecular Weight:
205.4795
MDL Number:
MFCD00045161
IUPAC Name:
1-bromo-2-chloro-4-methylbenzene
InChI:
InChI=1S/C7H6BrCl/c1-5-2-3-6(8)7(9)4-5/h2-4H,1H3
InChI Key:
SDTULEXOSNNGAW-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)Cl)Br
NSC Number:
60109
Properties
Complexity:
94.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.934g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.479g/mol
Monoisotopic Mass:
203.934g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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