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174913-47-4 | 4-Chloro-3,5-dibromoanisole
CAS No: 174913-47-4 Catalog No: AG01FFEZ MDL No:MFCD11845904
Product Description
Catalog Number:
AG01FFEZ
Chemical Name:
4-Chloro-3,5-dibromoanisole
CAS Number:
174913-47-4
Molecular Formula:
C7H5Br2ClO
Molecular Weight:
300.3750
MDL Number:
MFCD11845904
IUPAC Name:
1,3-dibromo-2-chloro-5-methoxybenzene
InChI:
InChI=1S/C7H5Br2ClO/c1-11-4-2-5(8)7(10)6(9)3-4/h2-3H,1H3
InChI Key:
ZSOCQOCQLMDAJL-UHFFFAOYSA-N
SMILES:
COc1cc(Br)c(c(c1)Br)Cl
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.838g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.374g/mol
Monoisotopic Mass:
297.84g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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