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4619-74-3 | 2,4,6-Tribromo-3-methylphenol
CAS No: 4619-74-3 Catalog No: AG003FMH MDL No:MFCD00019976
Product Description
Catalog Number:
AG003FMH
Chemical Name:
2,4,6-Tribromo-3-methylphenol
CAS Number:
4619-74-3
Molecular Formula:
C7H5Br3O
Molecular Weight:
344.8260
MDL Number:
MFCD00019976
IUPAC Name:
2,4,6-tribromo-3-methylphenol
InChI:
InChI=1S/C7H5Br3O/c1-3-4(8)2-5(9)7(11)6(3)10/h2,11H,1H3
InChI Key:
QKHROXOPRBWBDD-UHFFFAOYSA-N
SMILES:
Cc1c(Br)cc(c(c1Br)O)Br
EC Number:
225-032-4
UNII:
Q3Z845166M
NSC Number:
74686
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.787g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.828g/mol
Monoisotopic Mass:
341.789g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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